SCHEMBL852720

SCHEMBL852720

C[C@H](O)c1cccc(Br)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
UGT2B7 P16662 1/20 0.47
ALDH1A1 P00352 2/20 0.45
MAPK1 P28482 1/20 0.44
HSD11B1 P28845 1/20 0.44
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
CYP3A4 P08684 3/20 0.42
CYP2D6 P10635 3/20 0.42
SLC6A2 P23975 3/20 0.42
SLC6A4 P31645 3/20 0.42
SLC6A3 Q01959 3/20 0.42
KCNH2 Q12809 1/20 0.42
MBTD1 Q05BQ5 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
BRD4 O60885 1/20 0.41
BRD2 P25440 1/20 0.41
CREBBP Q92793 1/20 0.41
NPC1 O15118 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1285074 1.00 MEN1 (0.47) MEN1KMT2AUGT2B7ALDH1A1MAPK1
SCHEMBL343476 1.00 MEN1 (0.47) MEN1KMT2AUGT2B7ALDH1A1MAPK1
SCHEMBL29626738 1.00 MEN1 (0.47) MEN1KMT2AUGT2B7ALDH1A1MAPK1
SCHEMBL1812811 0.84 SLC6A2 (0.51) ALDH1A1MAPK1IDO1TDO2CYP3A4
SCHEMBL9331663 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7ALDH1A1CYP3A4
SCHEMBL2812852 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7ALDH1A1CYP3A4
SCHEMBL9331659 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7ALDH1A1CYP3A4
SCHEMBL9334664 0.83 UGT2B7 (0.56) MEN1KMT2AUGT2B7ALDH1A1CYP3A4
SCHEMBL13963168 0.83 CYP3A4 (0.47) ALDH1A1MAPK1IDO1TDO2CYP3A4
SCHEMBL11216092 0.83 ALDH1A1 (0.42) ALDH1A1MAPK1IDO1TDO2CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250230169-A1 Phosphoinositide 3-Kinase Inhibitors with a Zinc Binding Moiety CURIS INC (US) 2025-07-17 US disclosed
US-20230227467-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2023-07-20 US disclosed
US-11597732-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2023-03-07 US disclosed
US-20220402934-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2022-12-22 US disclosed
US-11377425-B1 Small molecule modulators of IL-17 LEO PHARMA A/S (DK) 2022-07-05 US disclosed
US-11377425-B1 Small molecule modulators of IL-17 LEO PHARMA A/S (DK) 2022-07-05 US disclosed
US-11261195-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2022-03-01 US disclosed
US-20210214370-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2021-07-15 US disclosed
CN-108101741-B Method for synthesizing chiral alcohol by alkyne hydration/asymmetric hydrogenation tandem 三峡大学 2021-06-29 CN disclosed
US-10894795-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2021-01-19 US disclosed
US-7642073-B2 Using mixture comprising modified alcohol dehydrogenase, ammonia, nicotinamide and 2-ketoacid to generate preferential amino acids CODEXIS, INC. (US) 2010-01-05 US disclosed
CN-100398626-C Method for increasing helical twist rate, optically active compound, liquid crystal composition containing the same, and liquid crystal display element DAINIPPON INK & CHEMICALS (JP) 2008-07-02 CN disclosed
US-20080076162-A1 Using mixture comprising modified alcohol dehydrogenase, ammonia, nicotinamide and 2-ketoacid to generate preferential amino acids BIOCATALYTICS, INC. 2008-03-27 US disclosed
US-7202070-B2 Generating phenylalanine and leucine using mutant enzymatic polypeptide; generate mutant enzyme, aminate ketoacid, recover amino acids BIOCATALYTICS, INC. (US) 2007-04-10 US disclosed
US-7108896-B2 Method of increasing helical twisting power, optically active compound, liquid crystal compostion containing the same, and liquid crystal display device DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-09-19 US disclosed
CN-1174103-C Process for preparing chiral substituted arylepoxyethane compounds and its biol by selective splitting of Aspergillus niger 中国科学院上海有机化学研究所 2004-11-03 CN disclosed
CN-1495246-A Method for increasing helical twist rate, optically active compound, liquid crystal composition containing the same, and liquid crystal display element 大日本油墨化学工业株式会社 2004-05-12 CN disclosed
US-20040021128-A1 Method of increasing helical twisting power, optically active compound, liquid crystal composition containing the same, and liquid crystal display device DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-02-05 US disclosed
US-20020061564-A1 Generating phenylalanine and leucine using mutant enzymatic polypeptide; generate mutant enzyme, aminate ketoacid, recover amino acids CODEXIS, INC. 2002-05-23 US disclosed
WO-2002036742-A2 METHOD FOR CHEMICAL TRANSFORMATION USING A MUTATED ENZYME BIOCATALYTICS, INC. (US) 2002-05-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11261195-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety BAZ2A, BAZ2B, PI4KB MEN1 3638/4885KMT2A 373/4885UGT2B7 3435/4885
US-20210214370-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB MEN1 3670/4885KMT2A 370/4885UGT2B7 3492/4885
US-11597732-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety BAZ2A, BAZ2B, PI4KB MEN1 3670/4885KMT2A 370/4885UGT2B7 3492/4885
US-11377425-B1 Small molecule modulators of IL-17 IL17A, IL15, IL2 MEN1 2191/4885KMT2A 3095/4885UGT2B7 146/4885
US-20250230169-A1 Phosphoinositide 3-Kinase Inhibitors with a Zinc Binding Moiety BAZ2A, BAZ2B, PI4KB MEN1 3638/4885KMT2A 373/4885UGT2B7 3435/4885
US-10894795-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety BAZ2A, BAZ2B, PI4KB MEN1 3670/4885KMT2A 370/4885UGT2B7 3492/4885
US-20230227467-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB MEN1 3638/4885KMT2A 373/4885UGT2B7 3435/4885
US-20220402934-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB MEN1 3638/4885KMT2A 373/4885UGT2B7 3435/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.