SCHEMBL1785686

SCHEMBL1785686

NC(=O)c1cc(F)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KEAP1 Q14145 1/20 0.47
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
KMT2A Q03164 2/20 0.46
ATM Q13315 1/20 0.46
CASP1 P29466 1/20 0.44
PARP1 P09874 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA3 P07451 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43

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
SCHEMBL2839520 0.83 KMT2A (0.53) ALDH1A1HPGDLMNACES2CES1
SCHEMBL30954398 0.83 CES2 (0.47) ALDH1A1HPGDLMNANPSR1KEAP1
SCHEMBL4615110 0.83 EIF4E (0.47) CASP1GRM2
SCHEMBL477556 0.81 CES2 (0.48) ALDH1A1HPGDKEAP1CES2CES1
SCHEMBL786240 0.81 ALDH1A1 (0.63) ALDH1A1LMNAMAPTKEAP1CES2
SCHEMBL29463969 0.80 CES2 (0.52) ALDH1A1LMNAKEAP1CES2CES1
SCHEMBL27676473 0.80 ALDH1A1 (0.46) ALDH1A1HPGDKEAP1CES2CES1
SCHEMBL5884181 0.79 CES2 (0.47) ALDH1A1HPGDLMNAKEAP1CES2
SCHEMBL15471930 0.79 ALDH1A1 (0.68) ALDH1A1HPGDLMNAMAPTKEAP1
SCHEMBL30219241 0.78 ALDH1A1 (0.65) ALDH1A1HPGDLMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 WO claimed
CN-106459030-B Replace tropane derivatives 东亚荣养株式会社 2019-01-29 CN claimed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
CN-104245675-B Cyclic amides as MetAP-2 inhibitors 默克专利股份公司 2017-10-13 CN claimed
EP-1648874-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2011-10-05 EP claimed
EP-1846035-B1 COMBINATION THERAPY XENON PHARMACEUTICALS INC (CA) 2011-09-21 EP claimed
US-20100056460-A1 COMBINATION OF ORGANIC COMPOUNDS ALI MOHAMMED A 2010-03-04 US claimed
CN-100556889-C N-replaces-2,4-two chloro-5-fluorobenzamides and preparation thereof and application UNIV ZHEJIANG TECHNOLOGY (CN) 2009-11-04 CN claimed
US-20090131447-A1 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2009-05-21 US claimed
EP-1773768-A4 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2008-08-06 EP claimed
CN-101163504-A Combination therapy XENON PHARMACEUTICALS INC (CA) 2008-04-16 CN claimed
EP-1907004-A2 COMBINATION OF A RENIN INHIBITOR AND AN INSULIN SECRETION ENHANCER OR AN INSULIN SENSITIZER Novartis AG (CH) 2008-04-09 EP claimed
US-7335658-B2 Pyridazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2008-02-26 US claimed
EP-1846035-A2 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2007-10-24 EP claimed
CN-101033198-A Compound of N-substituted-2,4-dichloro-5-fluorobenzamide, preparation and application thereof UNIV ZHEJIANG TECHNOLOGY (CN) 2007-09-12 CN claimed
EP-1773768-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS Exelixis, Inc. (US) 2007-04-18 EP claimed
WO-2007005763-A2 COMBINATION OF A RENIN INHIBITOR AND AN INSULIN SECRETION ENHANCER OR AN INSULIN SENSITIZER NOVARTIS AG (CH) 2007-01-11 WO claimed
WO-2006086445-A2 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2006-08-17 WO claimed
WO-2006012642-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS, INC. (US) 2006-02-02 WO claimed
US-20050065143-A1 Pyridazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2005-03-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20050065143-A1 Pyridazine derivatives and their use as therapeutic agents PRDX5, SNRPD3, SNRPD2 ALDH1A1 2432/4885HPGD 1795/4885LMNA 73/4885
US-20100056460-A1 COMBINATION OF ORGANIC COMPOUNDS REN, IAPP, ACE ALDH1A1 2324/4885HPGD 2261/4885LMNA 4240/4885
US-20090131447-A1 COMBINATION THERAPY SCD, SCD5, ARG1 ALDH1A1 1500/4885HPGD 2961/4885LMNA 769/4885

“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.