SCHEMBL2373643

SCHEMBL2373643

O=C1Nc2c(ccc(Br)c2F)C1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES1 P23141 10/20 0.47
ALDH1A1 P00352 1/20 0.44
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44
TGM2 P21980 3/20 0.43
DAO P14920 2/20 0.43
BCHE P06276 2/20 0.43
NSD2 O96028 1/20 0.43
LIG1 P18858 1/20 0.40
CASP3 P42574 1/20 0.36
CASP2 P42575 1/20 0.36
CASP7 P55210 1/20 0.36
CASP6 P55212 1/20 0.36
CASP8 Q14790 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
DNMT1 P26358 1/20 0.35
S100A4 P26447 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL29860116 0.80 CES1 (0.50) CES1ALDH1A1ALDH2ALDH3A1TGM2
SCHEMBL3076875 0.80 CES1 (0.50) CES1ALDH1A1ALDH2ALDH3A1TGM2
SCHEMBL30638871 0.78 SMN1; SMN2 (0.43) CES1ALDH1A1ALDH2ALDH3A1TGM2
SCHEMBL32662403 0.78 CA1 (0.32)
SCHEMBL16647187 0.77 CES1 (0.67) CES1ALDH1A1ALDH2ALDH3A1TGM2
SCHEMBL1092103 0.77 CES1 (0.62) CES1ALDH1A1ALDH2ALDH3A1TGM2
SCHEMBL3093497 0.77 DAO (0.56) CES1ALDH1A1ALDH2ALDH3A1TGM2
SCHEMBL14358786 0.77 CES1 (0.67) CES1TGM2DAOBCHENSD2
SCHEMBL30441928 0.77 CES1 (0.67) CES1TGM2DAOBCHENSD2
SCHEMBL15228756 0.77 CES1 (0.47) CES1ALDH1A1ALDH2ALDH3A1TGM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437315-B Thiazole bridged isoindigo receptor and polymer as well as preparation method and application thereof 中国科学院化学研究所 2022-12-06 CN claimed
CN-114437315-A Novel thiazole bridged isoindigo receptor and polymer as well as preparation method and application thereof 中国科学院化学研究所 2022-05-06 CN claimed
CN-112708111-A Novel methoxyindophenine receptor and polymer, and preparation method and application thereof 中国科学院化学研究所 2021-04-27 CN claimed
EP-4737455-A1 COMPOUND CONTAINING MULTI-FUSED RING STRUCTURE Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2026-05-06 EP disclosed
US-20260098037-A1 COMPOUND CONTAINING MULTI-FUSED RING STRUCTURE CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2026-04-09 US disclosed
US-20260078131-A1 PYRROLO-PYRIDAZINE INHIBITORS OF JAK2 AJAX THERAPEUTICS INC (US) 2026-03-19 US disclosed
US-20260015351-A1 METHODS AND COMPOUNDS FOR INHIBITING MKK7 ENZYMES AXONIS THERAPEUTICS INC (US) 2026-01-15 US disclosed
US-RE50490-E1 Substituted quinazoline compounds and methods of use thereof ARAXES PHARMA LLC (US) 2025-07-15 US disclosed
CN-120077044-A Compounds containing multiple condensed ring structures 正大天晴药业集团股份有限公司 2025-05-30 CN disclosed
WO-2025052129-A1 PYRIDINE DERIVATIVES WHICH ACT AS INHIBITORS OF MPTP. NRG THERAPEUTICS LTD (GB) 2025-03-13 WO disclosed
CN-116134035-B 3- (1H-imidazol-2-yl) -2,3,8 a-tetrahydroindol-5 (1H) -one derivatives useful as factor XIA inhibitors 詹森药业有限公司 2025-03-11 CN disclosed
US-20150239900-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2015-08-27 US disclosed
WO-2015054572-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2015-04-16 WO disclosed
WO-2015054572-A1 INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2015-04-16 WO disclosed
US-20140179682-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2014-06-26 US disclosed
US-20140179682-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2014-06-26 US disclosed
WO-2012170845-A2 METABOTROPIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF HEFFERNAN MICHELE L R (US) 2012-12-13 WO disclosed
WO-2012170845-A2 METABOTROPIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF HEFFERNAN MICHELE L R (US) 2012-12-13 WO disclosed
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 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 (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-20260078131-A1 PYRROLO-PYRIDAZINE INHIBITORS OF JAK2 JAK2, JAK1, JAK3 CES1 2833/4885ALDH1A1 2846/4885ALDH2 4172/4885
US-20260098037-A1 COMPOUND CONTAINING MULTI-FUSED RING STRUCTURE SLC5A2, SLC5A11, SLC5A1 CES1 1689/4885ALDH1A1 1814/4885ALDH2 887/4885
US-20150239900-A1 INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS CES1 3492/4885ALDH1A1 4178/4885ALDH2 4760/4885
US-20260015351-A1 METHODS AND COMPOUNDS FOR INHIBITING MKK7 ENZYMES PRKCSH, MAPK7, PRKCB CES1 75/4885ALDH1A1 2835/4885ALDH2 3232/4885
US-20140179682-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF GRM5, GRIK5, GRM2 CES1 940/4885ALDH1A1 2494/4885ALDH2 690/4885

“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.