SCHEMBL14219394

SCHEMBL14219394

C[C@@H](Cc1c(F)cc(C2CCC(c3ccc(C#N)cc3)CC2)cc1F)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40
SCD5 Q86SK9 2/20 0.39
EP300 Q09472 5/20 0.38
MGLL Q99685 1/20 0.38
SCD O00767 1/20 0.36
HAT1 O14929 2/20 0.35
TACR1 P25103 1/20 0.34
MRGPRX1 Q96LB2 1/20 0.34
USP30 Q70CQ3 3/20 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
SCHEMBL14219945 0.88 EP300 (0.40) SCD5EP300MGLLHAT1TACR1
SCHEMBL14219934 0.88 EP300 (0.40) SCD5EP300MGLLHAT1TACR1
SCHEMBL14219994 0.88 EP300 (0.38) GRIA1GRIA2GRIA3SCD5EP300
SCHEMBL14219583 0.88 EP300 (0.38) GRIA1GRIA2GRIA3SCD5EP300
SCHEMBL14219462 0.87 CCR1 (0.39) TACR1MRGPRX1
SCHEMBL14219465 0.84 ADRB2 (0.39)
SCHEMBL14220025 0.84 ADRB2 (0.39)
SCHEMBL14219915 0.83 MEN1 (0.39)
SCHEMBL14219398 0.83 MEN1 (0.39)
SCHEMBL14219467 0.83 GRIA1 (0.44) GRIA1GRIA2GRIA3EP300HAT1

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-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed