SCHEMBL2490332

SCHEMBL2490332

Fc1ccc(F)c(NCn2nnc3ccccc32)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 5/20 0.52
▸ RPS6KA3 P51812 1/20 0.51
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2C9 P11712 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ SLC9A1 P19634 6/20 0.46
▸ PTK2 Q05397 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44

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
SCHEMBL7269557 0.82 RPS6KA3 (0.52) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL4590984 0.79 RPS6KA3 (0.59) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL29754179 0.78 HSD17B10 (0.49) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL22546088 0.78 HSD17B10 (0.49) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL9618157 0.74 RPS6KA3 (0.84) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL27873758 0.74 RPS6KA3 (0.64) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL2488627 0.74 CYP1A2 (0.59) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL2490331 0.74 RPS6KA3 (0.60) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL3403852 0.73 SLC9A1 (0.63) GRM2RPS6KA3CYP1A2CYP2C9CYP2C19
SCHEMBL2490229 0.73 NPC1 (0.59) RPS6KA3CYP1A2CYP2C9CYP2C19POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8330039-B2 Solar cell modules with poly(vinyl butyral) encapsulant comprising unsaturated heterocyclic compound E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-11 — — US disclosed
EP-2380208-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. du Pont de Nemours and Company (US) 2011-10-26 — — EP disclosed
WO-2010085664-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-29 — — WO disclosed
US-20100180947-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-22 — — US disclosed
US-6653353-B2 Hair styling anionic polymer and fluoroamines mixture improves the holding power of styling resins under high humidity conditions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-25 — — US disclosed
US-20020176834-A1 Cosmetic and personal care compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-11-28 — — US disclosed
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