SCHEMBL19984585

SCHEMBL19984585

CC(C)C(=O)CC(=O)Nc1cccc(Br)c1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.67
ALDH1A1 P00352 5/20 0.58
HPGD P15428 1/20 0.58
MAOA P21397 1/20 0.55
MAOB P27338 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
RAB9A P51151 1/20 0.51
MAPT P10636 2/20 0.51
EGFR P00533 1/20 0.50
HTT P42858 1/20 0.50
ATM Q13315 1/20 0.50
TGM2 P21980 1/20 0.50
POLB P06746 1/20 0.49

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
SCHEMBL29893001 1.00 GAA (0.67) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL5142687 0.85 GAA (0.77) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL378588 0.83 GAA (0.69) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL7429227 0.82 GAA (0.73) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL29893024 0.82 GAA (0.73) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL1616576 0.81 HPGD (0.57) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL14519972 0.80 ALDH1A1 (0.75) GAAALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL5690831 0.80 GAA (1.00) GAAALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL34460125 0.80 ALDH1A1 (0.75) GAAALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL28712302 0.80 GAA (0.70) GAAALDH1A1HPGDMAOAMAOB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313308-A1 TEAD INHIBITORS AND USES THEREOF Cedilla Therapeutics, Inc. (US) 2024-02-07 EP disclosed
US-20230098872-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. 2023-03-30 US disclosed
WO-2022204452-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2022-09-29 WO disclosed
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2022-01-27 US disclosed
US-10987360-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2021-04-27 US disclosed
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2019-08-22 US disclosed
WO-2018053157-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES, INC. (US) 2018-03-22 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 (4 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-20230098872-A1 TEAD INHIBITORS AND USES THEREOF TEAD2, TEAD3, TEAD4 GAA 147/4885ALDH1A1 1319/4885HPGD 299/4885
US-10987360-B2 Hepatitis B core protein modulators HAVCR2, FABP1, MAVS GAA 2421/4885ALDH1A1 3992/4885HPGD 2902/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS GAA 2421/4885ALDH1A1 3992/4885HPGD 2902/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS GAA 2421/4885ALDH1A1 3992/4885HPGD 2902/4885

“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.