SCHEMBL7005085

SCHEMBL7005085

N#Cc1ccc(P)c(C#N)c1C#N.N#Cc1ccc(P)c(C#N)c1C#N.N#Cc1ccc(P)c(C#N)c1C#N.N#Cc1ccc(P)c(C#N)c1C#N.[Pd]

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 2/20 0.34
▸ PGR P06401 1/20 0.31
▸ AR P10275 1/20 0.31
▸ TSHR P16473 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
SCHEMBL3842875 0.98 TRPV4 (0.35) TRPV4PGRARTSHR
SCHEMBL152358 0.82 TSHR (0.39) TRPV4PGRARTSHR
SCHEMBL31399295 0.82 TSHR (0.39) TRPV4PGRARTSHR
Acetonitrile SCHEMBL9498906 0.74 ALDH1A1 (0.40) TRPV4PGRARTSHR
Hexamethylbenzene SCHEMBL4271177 0.72 TSHR (0.44) PGRARTSHR
SCHEMBL9843268 0.70 AR (0.33) TRPV4PGRARTSHR
SCHEMBL15659464 0.69 — —
SCHEMBL20690651 0.69 AR (0.42) TRPV4PGRARTSHR
SCHEMBL17570552 0.68 TSHR (0.46) PGRARTSHR
SCHEMBL7299363 0.68 UPP1 (0.34) TRPV4PGRARTSHR

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
EP-1298176-A2 Stacked film insulating film and substrate for semiconductor JSR Corporation (JP) 2003-04-02 — — EP disclosed
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