SCHEMBL20831760

SCHEMBL20831760

C[C@H](c1cccnc1CC(F)(F)F)N1CCN(c2cn[nH]c(=O)c2C#N)[C@H](C)C1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 6/20 0.38
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 1/20 0.33
▸ TIPARP Q7Z3E1 6/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ GPR119 Q8TDV5 1/20 0.31
▸ GRM2 Q14416 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
SCHEMBL20831758 1.00 TRPC5 (0.38) TRPC5HCRTR1HCRTR2TIPARPKCNH2
SCHEMBL20831245 1.00 TRPC5 (0.38) TRPC5HCRTR1HCRTR2TIPARPKCNH2
SCHEMBL20818320 0.91 TRPC5 (0.40) TRPC5TIPARPGPR119GRM2
SCHEMBL20818318 0.91 TRPC5 (0.40) TRPC5TIPARPGPR119GRM2
SCHEMBL20831944 0.91 TRPC5 (0.40) TRPC5TIPARPGPR119GRM2
SCHEMBL20831551 0.88 TRPC5 (0.44) TRPC5TIPARPKCNH2
SCHEMBL20831476 0.88 TRPC5 (0.44) TRPC5TIPARPKCNH2
SCHEMBL20831246 0.88 TRPC5 (0.44) TRPC5TIPARPKCNH2
SCHEMBL20831248 0.85 TRPC5 (0.36) TRPC5TIPARPKCNH2GPR119
SCHEMBL20831545 0.85 TRPC5 (0.36) TRPC5TIPARPKCNH2GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019055966-A2 PYRIDAZINONES AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-03-21 — — WO disclosed
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