SCHEMBL2494160

SCHEMBL2494160

CCN1C2=NCCN2C(=O)c2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.67
▸ POLB P06746 1/20 0.56
▸ LMNA P02545 2/20 0.52
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ GAA P10253 1/20 0.47
▸ GFER P55789 1/20 0.47
▸ ALDH1A1 P00352 6/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ CYP2D6 P10635 2/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ MPI P34949 1/20 0.43
▸ CACNA1B Q00975 1/20 0.43
▸ APBA1 Q02410 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42

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
SCHEMBL2493279 0.83 TSHR (0.83) TSHRLMNAKMT2AMEN1GAA
SCHEMBL11842041 0.83 TSHR (0.60) TSHRPOLBLMNAKMT2AMEN1
SCHEMBL11852039 0.82 TSHR (0.62) TSHRLMNAKMT2AMEN1GAA
SCHEMBL11855311 0.81 TSHR (0.58) TSHRPOLBLMNAALDH1A1
SCHEMBL11477847 0.81 TSHR (0.56) TSHRLMNAKMT2AMEN1GAA
SCHEMBL11845293 0.80 TSHR (1.00) TSHRLMNAKMT2AMEN1GAA
SCHEMBL11804290 0.80 TSHR (0.47) TSHRPOLBLMNAKMT2AMEN1
SCHEMBL11838764 0.79 TSHR (0.72) TSHRPOLBLMNAKMT2AMEN1
SCHEMBL11841114 0.79 TSHR (0.59) TSHRLMNAGAAGFERALDH1A1
SCHEMBL11847278 0.79 TSHR (0.80) TSHRLMNAKMT2AMEN1GAA

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 5 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-3969506-A BRONCHODILATOR SANDOZ, INC. (US) 1976-07-13 — — US disclosed
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