SCHEMBL7429227

SCHEMBL7429227

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

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.73
ALDH1A1 P00352 4/20 0.63
HPGD P15428 1/20 0.63
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
KDM4E B2RXH2 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C19 P33261 1/20 0.57
HIF1A Q16665 1/20 0.57
MAPT P10636 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
RAB9A P51151 1/20 0.55
TGM2 P21980 1/20 0.54
HTT P42858 1/20 0.54
ATM Q13315 1/20 0.54
EGFR P00533 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL29893024 1.00 GAA (0.73) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL5142687 0.89 GAA (0.77) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL8752439 0.87 MEN1 (0.66) GAAALDH1A1MEN1KMT2AKDM4E
SCHEMBL5690831 0.84 GAA (1.00) GAAALDH1A1HPGDMEN1KMT2A
SCHEMBL29388992 0.84 GAA (0.70) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL15145824 0.84 GAA (0.70) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL28712302 0.84 GAA (0.70) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL11761862 0.82 RAB9A (0.74) ALDH1A1MEN1KMT2AKDM4ECYP1A2
SCHEMBL28627031 0.82 GAA (0.72) GAAALDH1A1HPGDMAOAMAOB
SCHEMBL3715355 0.82 GAA (0.72) 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 WO disclosed
EP-4313308-A1 TEAD INHIBITORS AND USES THEREOF Cedilla Therapeutics, Inc. (US) 2024-02-07 EP disclosed
US-20230158025-A1 GALACTOKINASE INHIBITORS NATIONAL INSTITUTES OF HEALTH 2023-05-25 US 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
WO-2021216812-A1 GALACTOKINASE INHIBITORS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2021-10-28 WO 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
CN-109937201-A HEPATITIS B CORE PROTEIN MODULATORS 组装生物科学股份有限公司 2019-06-25 CN disclosed
WO-2018053157-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES, INC. (US) 2018-03-22 WO disclosed
US-6200976-B1 FOR TREATING THROMBOSIS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-03-13 US disclosed
EP-1071669-A1 BICYCLIC COMPOUNDS HAVING AN ANTI-THROMBITIC EFFECT Boehringer Ingelheim Pharma KG (DE) 2001-01-31 EP disclosed
WO-1999054313-A1 BICYCLIC COMPOUNDS HAVING AN ANTI-THROMBITIC EFFECT BOEHRINGER INGELHEIM PHARMA KG (DE) 1999-10-28 WO disclosed
EP-0096214-B1 ANTIBACTERIAL PYRIMIDINE COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1991-02-27 EP disclosed
US-4587341-A BACTERICIDES BURROUGHS WELLCOME CO. (US) 1986-05-06 US disclosed
EP-0096214-A1 Antibacterial pyrimidine compounds THE WELLCOME FOUNDATION LIMITED (GB) 1983-12-21 EP disclosed
US-4014679-A HERBICIDES ROUSSEL-UCLAF (FR) 1977-03-29 US 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 (5 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-20230158025-A1 GALACTOKINASE INHIBITORS GALK1, GCK, GCKR GAA 101/4885ALDH1A1 3139/4885HPGD 2300/4885
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.