SCHEMBL29630954

SCHEMBL29630954

OB(O)Oc1ccc(C(F)(F)F)nc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 1/20 0.47
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ CHRNB2 P17787 1/20 0.40
▸ CHRNA4 P43681 1/20 0.40
▸ LIPE Q05469 1/20 0.39
▸ SCN9A Q15858 9/20 0.39
▸ PLAAT3 P53816 1/20 0.36
▸ PLAAT5 Q96KN8 1/20 0.36
▸ PLAAT2 Q9NWW9 1/20 0.36
▸ PLAAT4 Q9UL19 1/20 0.36
▸ HDAC4 P56524 1/20 0.35
▸ GRM5 P41594 1/20 0.35
▸ SCN10A Q9Y5Y9 5/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ SCN8A Q9UQD0 2/20 0.34

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
SCHEMBL15750456 1.00 TRPV4 (0.47) TRPV4MRGPRX4CHRNB2CHRNA4LIPE
SCHEMBL29267532 0.92 TRPV4 (0.41) TRPV4MRGPRX4CHRNB2CHRNA4LIPE
SCHEMBL28451946 0.76 — —
SCHEMBL28702984 0.76 L3MBTL1 (0.53) LIPESCN9A
SCHEMBL1890852 0.75 CHRNB2 (0.38) CHRNB2CHRNA4
SCHEMBL929327 0.75 TRPV4 (0.52) TRPV4MRGPRX4CHRNB2CHRNA4SCN9A
SCHEMBL1146113 0.75 TRPV4 (0.52) TRPV4MRGPRX4CHRNB2CHRNA4SCN9A
SCHEMBL14551864 0.74 TRPV4 (0.47) TRPV4MRGPRX4CHRNB2CHRNA4LIPE
SCHEMBL581887 0.73 TRPV4 (0.50) TRPV4MRGPRX4CHRNB2CHRNA4LIPE
SCHEMBL31130640 0.73 TRPV4 (0.50) TRPV4MRGPRX4CHRNB2CHRNA4LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111770918-B Inhibitors of TRPC6 勃林格殷格翰国际公司 2024-02-27 — — CN disclosed
CN-115362003-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2022-11-18 — — CN disclosed
CN-110267959-B Imidazo [1,5-A ] pyrazine derivatives as PI3K delta inhibitors 百济神州有限公司 2022-05-27 — — CN disclosed
CN-109563094-B (hetero) aryl-substituted piperidinyl derivatives, process for their preparation and pharmaceutical compositions containing them 法国施维雅药厂 2022-03-18 — — CN disclosed
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