SCHEMBL17596161

SCHEMBL17596161

COC(=O)c1ccc(N)c(Br)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.50
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 3/20 0.50
GLA P06280 3/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
CFTR P13569 2/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
ABL1 P00519 1/20 0.49
TSHR P16473 3/20 0.47
ALOX15 P16050 1/20 0.47
PTGER4 P35408 1/20 0.44
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CA12 O43570 1/20 0.41
CA7 P43166 1/20 0.41

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
SCHEMBL136404 0.83 ALDH1A1 (0.55) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL19608389 0.81 CA12 (0.43) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL1028047 0.81 CA1 (0.43) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL2426826 0.81 PTGER4 (0.54) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL31503856 0.81 ABL1 (0.56) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL21438533 0.80 CA1 (0.50) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL31184502 0.80 CA1 (0.50) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL2079806 0.79 KDM4E (0.50) GAAKDM4EALDH1A1HSD17B10GLA
SCHEMBL25522125 0.79 MAPT (0.38) KDM4EALDH1A1GLAMAPTHPGD
SCHEMBL9277089 0.79 NPC1 (0.42) GAAKDM4EALDH1A1HSD17B10GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 WO disclosed
WO-2024130095-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-20 WO disclosed
US-20230159510-A1 NOVEL PRMT5 INHIBITORS AMGEN INC. (US) 2023-05-25 US disclosed
US-20230159510-A1 NOVEL PRMT5 INHIBITORS AMGEN INC. (US) 2023-05-25 US disclosed
EP-4103558-A1 NOVEL PRMT5 INHIBITORS Amgen Inc. (US) 2022-12-21 EP disclosed
WO-2021163344-A1 NOVEL PRMT5 INHIBITORS AMGEN INC. (US) 2021-08-19 WO disclosed
WO-2021163344-A1 NOVEL PRMT5 INHIBITORS AMGEN INC. (US) 2021-08-19 WO disclosed
CN-106715425-B Herbicidal quinolines 先正达参股股份有限公司 2020-11-06 CN disclosed
EP-3191465-B1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2018-12-19 EP disclosed
US-9980486-B2 Herbicidal quinolines SYNGENTA PARTICIPATIONS AG (CH) 2018-05-29 US disclosed
US-20170251670-A1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2017-09-07 US disclosed
EP-3191465-A1 HERBICIDAL QUINOLINES Syngenta Participations AG (CH) 2017-07-19 EP disclosed
WO-2016038173-A1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2016-03-17 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 (2 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-20230159510-A1 NOVEL PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 GAA 3863/4885KDM4E 45/4885ALDH1A1 3191/4885
US-20170251670-A1 HERBICIDAL QUINOLINES NQO2, DDT, ATP1B1 GAA 396/4885KDM4E 1955/4885ALDH1A1 33/4885

“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.