SCHEMBL31353077

SCHEMBL31353077

N#Cc1c(F)cc(Cl)c(F)c1I

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
KHK P50053 1/20 0.31
EPAS1 Q99814 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL29176715 0.81 TRPV4 (0.39) TRPV4TAS1R3TAS1R1TAS1R2MEN1
SCHEMBL24253799 0.78 TRPV4 (0.52) TRPV4
SCHEMBL31376014 0.77 LMNA (0.36) EPAS1ALDH1A1TP53CYP3A4MAPT
SCHEMBL23087497 0.76 TRPV4 (0.42) TRPV4TAS1R3TAS1R1TAS1R2KHK
SCHEMBL7629039 0.75 TRPV4 (0.45) TRPV4TAS1R3TAS1R1TAS1R2KHK
SCHEMBL1806589 0.73 TRPV4 (0.43) TRPV4TAS1R3TAS1R1TAS1R2KHK
SCHEMBL25242758 0.73 TRPV4 (0.34) TRPV4TAS1R3TAS1R1TAS1R2EPAS1
SCHEMBL9693854 0.73 TRPV4 (0.41) TRPV4TAS1R3TAS1R1TAS1R2KHK
SCHEMBL31388135 0.73 ALDH1A1 (0.49) MEN1ALDH1A1TP53MAPTHPGD
SCHEMBL3842293 0.72 TRPV4 (0.46) TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119301101-A Methylpyrazole compound, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2025-01-10 CN disclosed
CN-119143752-A Aminoquinoline derivative, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2024-12-17 CN disclosed