SCHEMBL29995657

SCHEMBL29995657

FC(F)(F)c1ccc(CCl)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.52
DAO P14920 3/20 0.45
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
TKT P29401 1/20 0.40
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
KCNH2 Q12809 2/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
KCNQ4 P56696 1/20 0.37
KCNQ5 Q9NR82 1/20 0.37
LCK P06239 1/20 0.37
PGR P06401 1/20 0.37
CSF1R P07333 1/20 0.37
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37

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
SCHEMBL345116 1.00 TRPV4 (0.52) TRPV4DAOKDM1AMAOAMAOB
Hydrochloric Acid SCHEMBL22400793 0.98 TRPV4 (0.50) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL7996113 0.86 TRPV4 (0.36) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL7995933 0.86 TRPV4 (0.36) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL9840264 0.84 TRPV4 (0.35) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL7999416 0.81 CA1 (0.38) TRPV4DAOKCNH2
SCHEMBL317731 0.79 TRPV4 (0.52) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL129948 0.79 TRPV4 (0.52) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL456311 0.79 TRPV4 (0.57) TRPV4DAOKDM1AMAOAMAOB
SCHEMBL452178 0.79 TRPV4 (0.52) TRPV4DAOKDM1AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4624465-A1 COMPOUND SERVING AS DDR1 KINASE INHIBITOR, AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2025-10-01 EP disclosed
CN-110770214-B Heterocyclic P2X7 antagonists 布雷耶疗法有限公司 2024-03-29 CN disclosed
CN-112218865-B Pteridinone compounds and uses thereof 沃泰克斯药物股份有限公司 2024-03-12 CN disclosed
EP-4288433-A1 NOVEL COMPOUNDS Cerevance, Inc. (US) 2023-12-13 EP disclosed
CN-116981665-A Novel compounds 思瑞万斯公司 2023-10-31 CN disclosed
CN-111349087-B Compounds and methods for inhibiting fascin 康奈尔大学 2023-07-14 CN disclosed
CN-115947681-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2023-04-11 CN disclosed
CN-109641844-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2022-11-01 CN disclosed
WO-2022167819-A1 NOVEL COMPOUNDS Cerevance, Inc. (US) 2022-08-11 WO disclosed