SCHEMBL7939349

SCHEMBL7939349

NC(CC(=O)O)c1cc(F)cc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EEF2K O00418 3/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
GBA1 P04062 3/20 0.37
GABBR2 O75899 1/20 0.36
GABBR1 Q9UBS5 1/20 0.36
MEN1 O00255 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
FFAR1 O14842 1/20 0.35
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
CTSA P10619 2/20 0.34

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
SCHEMBL21314455 1.00 EEF2K (0.42) EEF2KKMT2ASMN1; SMN2CES2CES1
SCHEMBL14698312 0.88 KMT2A (0.38) EEF2KKMT2ASMN1; SMN2CES2CES1
Hydrochloric Acid SCHEMBL19949271 0.86 KMT2A (0.37) EEF2KKMT2ASMN1; SMN2CES2CES1
Hydrochloric Acid SCHEMBL19949272 0.86 KMT2A (0.37) EEF2KKMT2ASMN1; SMN2CES2CES1
SCHEMBL5720869 0.82 KMT2A (0.55) KMT2ASMN1; SMN2CES2CES1GBA1
SCHEMBL4011437 0.82 KMT2A (0.55) KMT2ASMN1; SMN2CES2CES1GBA1
SCHEMBL30661805 0.82 KMT2A (0.55) KMT2ASMN1; SMN2CES2CES1GBA1
SCHEMBL3511663 0.82 KMT2A (0.55) KMT2ASMN1; SMN2CES2CES1GBA1
SCHEMBL22088585 0.81 CES2 (0.45) EEF2KCES2CES1FFAR1CTSA
Hydrochloric Acid SCHEMBL4014614 0.80 KMT2A (0.54) KMT2ASMN1; SMN2CES2CES1GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3538526-B1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2024-04-10 EP disclosed
CN-117157285-A Pharmaceutical compounds as ubiquitin-specific protease 19 (USP 19) inhibitors 阿尔麦克探索有限公司 2023-12-01 CN disclosed
US-11639353-B2 Cyclobutanes- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2023-05-02 US disclosed
CN-110167934-B Cyclobutane-and azetidine-containing monocyclic and spiro compounds as alpha V integrin inhibitors 百时美施贵宝公司 2022-06-10 CN disclosed
US-20210246136-A1 CYCLOBUTANES- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-08-12 US disclosed
US-11014922-B2 Cyclobutane- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-05-25 US disclosed
EP-3538526-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS Bristol-Myers Squibb Company (US) 2019-09-18 EP disclosed
US-20190270741-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-05 US disclosed
US-20180237441-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-08-23 US disclosed
CN-108349984-A The derivative of 1- Phenylpyrrolidine -2- ketone as PERK inhibitor 葛兰素史密斯克莱知识产权(第2 号)有限公司 2018-07-31 CN disclosed
US-20110306593-A1 GAMMA SECRETASE MODULATORS MERCK SHARP & DOHME LLC 2011-12-15 US disclosed
US-20110218341-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-09-08 US disclosed
US-20110218341-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-09-08 US disclosed
US-7960310-B2 Method of combating and controlling insects SYNGENTA PARTICIPATIONS AG (CH) 2011-06-14 US disclosed
US-7960310-B2 Method of combating and controlling insects SYNGENTA PARTICIPATIONS AG (CH) 2011-06-14 US disclosed
EP-1919886-B1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-10-06 EP disclosed
WO-2010056722-A1 GAMMA SECRETASE MODULATORS SCHERING CORPORATION (US) 2010-05-20 WO disclosed
US-20080300285-A1 Chemical Compounds SYNGENTA CROP PROTECTION, INC. (US) 2008-12-04 US disclosed
US-20080300285-A1 Chemical Compounds SYNGENTA CROP PROTECTION, INC. (US) 2008-12-04 US disclosed
WO-2007020377-A2 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2007-02-22 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-20190270741-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS ITGB1, ITGAV, ITGA1 EEF2K 3392/4885KMT2A 3659/4885SMN1; SMN2 2576/4885
US-20080300285-A1 Chemical Compounds CHRM5, OR10J3, CHRM3 EEF2K 4828/4885KMT2A 2973/4885SMN1; SMN2 1754/4885
US-20110306593-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 EEF2K 1176/4885KMT2A 3486/4885SMN1; SMN2 536/4885
US-20210246136-A1 CYCLOBUTANES- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS ITGB1, ITGAV, ITGA1 EEF2K 3375/4885KMT2A 3761/4885SMN1; SMN2 2721/4885
US-11639353-B2 Cyclobutanes- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors ITGB1, ITGB2, ITGA1 EEF2K 3398/4885KMT2A 3748/4885SMN1; SMN2 2790/4885
US-11014922-B2 Cyclobutane- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors ITGB1, ITGB2, ITGA1 EEF2K 3662/4885KMT2A 3517/4885SMN1; SMN2 2636/4885
US-20180237441-A1 Chemical Compounds PSEN1, IRS1, CPT1A EEF2K 255/4885KMT2A 4383/4885SMN1; SMN2 51/4885
US-20110218341-A1 CHEMICAL COMPOUNDS OR10J3, NR0B1, NR0B2 EEF2K 4822/4885KMT2A 2793/4885SMN1; SMN2 1755/4885

“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.