SCHEMBL170401

SCHEMBL170401

CC(C)c1cccc(C(C)C)c1N=C=Nc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.42
GABRA1 P14867 3/20 0.38
LMNA P02545 2/20 0.38
GABRB2 P47870 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
FAAH O00519 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
GABRB1 P18505 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR2C P28335 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL134760 0.88 GABRA1 (0.46) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL1745784 0.86 GABRA1 (0.39) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL170297 0.84 FABP3 (0.37) MIFGABRA1GABRB2
SCHEMBL7730554 0.83 MIF (0.43) MIFGABRA1LMNAGABRB2GABRG2
Carbimide SCHEMBL27153413 0.82 GABRA1 (0.41) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL24228574 0.79 GABRA1 (0.39) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL11416327 0.77 GABRA1 (0.40) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL14347690 0.76 GABRA1 (0.36) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL11418776 0.76 TSHR (0.44) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL22280354 0.76 CYP3A4 (0.42) MIFGABRA1LMNAGABRB2GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921465-B2 Polybutylene terephthalate resin composition WINTECH POLYMER LTD. (JP) 2014-12-30 US disclosed
US-20130203905-A1 POLYBUTYLENE TEREPHTHALATE RESIN COMPOSITION WINTECH POLYMER LTD. (JP) 2013-08-08 US disclosed
EP-2578633-A1 POLYBUTYLENE TEREPHTHALATE RESIN COMPOSITION Wintech Polymer Ltd. (JP) 2013-04-10 EP disclosed
EP-1486536-B2 FLAME-RETARDANT RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-10-10 EP disclosed
EP-1452567-B1 FLAME-RETARDANT RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-03-07 EP disclosed
EP-1466946-B1 FLAME-RETARDANT RESIN COMPOSITION POLYPLASTICS CO (JP) 2011-11-09 EP disclosed
US-7498375-B2 Flame-retardant resin composition POLYPLASTICS CO., LTD. (JP) 2009-03-03 US disclosed
US-7205346-B2 halogen-free, fireproof mixture of thermoplastic resins, containing phosphorus compounds, aromatic resins, nitrogen compounds, metal compounds, stabilizer agents and water repellants POLYPLASTICS CO., LTD. (JP) 2007-04-17 US disclosed
EP-1486536-B1 FLAME-RETARDANT RESIN COMPOSITION POLYPLASTICS CO (JP) 2007-01-24 EP disclosed
US-7115677-B2 Flame-retardant resin composition POLYPLASTICS CO., LTD. (JP) 2006-10-03 US disclosed
US-20050004292-A1 Flame-retardant resin composition POLYPLASTICS CO., LTD. (JP) 2005-01-06 US disclosed
US-20040266916-A1 Flame-retardant resin composition POLYPLASTICS CO., LTD. (JP) 2004-12-30 US disclosed
US-20040254270-A1 Flame-retardant resin composition POLYPLASTICS CO., LTD. (JP) 2004-12-16 US disclosed
EP-1486536-A1 FLAME-RETARDANT RESIN COMPOSITION Polyplastics Co Ltd (JP) 2004-12-15 EP disclosed
EP-1466946-A1 FLAME-RETARDANT RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2004-10-13 EP disclosed
EP-1452567-A1 FLAME-RETARDANT RESIN COMPOSITION Polyplastics Co Ltd (JP) 2004-09-01 EP disclosed