SCHEMBL23925359

SCHEMBL23925359

N#Cc1cc(Cl)c(N)c(Cl)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KHK P50053 1/20 0.42
ALDH1A1 P00352 2/20 0.34
CYP3A4 P08684 2/20 0.34
TRPV4 Q9HBA0 3/20 0.34
CYP11B2 P19099 2/20 0.33
CSNK1A1 P48729 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
MAPK1 P28482 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL11687207 0.81 ALDH1A1 (0.39) KHKALDH1A1CYP3A4TRPV4CSNK1A1
SCHEMBL8727200 0.81 TRPV4 (0.38) KHKALDH1A1TRPV4CYP11B2MAPK1
SCHEMBL8045190 0.79 ALDH1A1 (0.37) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL10558774 0.78 KHK (0.41) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL7202604 0.77 TRPV4 (0.38) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL204055 0.76 AR (0.36) KHKALDH1A1CYP3A4TRPV4AR
SCHEMBL8664249 0.74 TRPV4 (0.39) KHKALDH1A1TRPV4CYP11B2MAPK1
SCHEMBL16236615 0.73 KHK (0.43) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL793224 0.73 KHK (0.43) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL16122585 0.73 ALDH1A1 (0.36) KHKALDH1A1CYP3A4TRPV4CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315834-B Imidazolone derivatives and their use in medicine 成都百裕制药股份有限公司 2024-01-05 CN disclosed
EP-4137491-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE Chengdu Baiyu Pharmaceutical Co., Ltd. (CN) 2023-02-22 EP disclosed
CN-114315834-A Imidazolidinone derivatives and their use in medicaments 成都百裕制药股份有限公司 2022-04-12 CN disclosed
WO-2021209055-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2021-10-21 WO disclosed
WO-2021209055-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2021-10-21 WO disclosed