SCHEMBL1979236

SCHEMBL1979236

CCC(C)CCc1ccc(CCC(C)CC)cc1.[LiH].[LiH]

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.38
CHRNA6 Q15825 1/20 0.38
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
OPRK1 P41145 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ADRB2 P07550 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL28383696 0.91 TAAR1 (0.48) CHRNB2CHRNA6TAAR1TSHR
SCHEMBL10711841 0.89 TSHR (0.46) HTTSMN1; SMN2KDM4ETSHR
SCHEMBL9821375 0.89 TSHR (0.46) HTTSMN1; SMN2KDM4ETSHR
SCHEMBL9766501 0.87 CHRNB2 (0.35) CHRNB2CHRNA6HTTSMN1; SMN2TAAR1
SCHEMBL11582747 0.87 ESR1 (0.52) HTTTAAR1OPRK1KDM4EADRB2
SCHEMBL22340602 0.87 TAAR1 (0.40) CHRNB2CHRNA6HTTSMN1; SMN2TAAR1
SCHEMBL27906651 0.87 GFER (0.52) TAAR1TSHR
SCHEMBL25824860 0.87 TAAR1 (0.45) TAAR1KDM4E
SCHEMBL19231716 0.87 HRH3 (0.41) TAAR1
SCHEMBL598729 0.86 TSHR (0.47) HTTSMN1; SMN2KDM4ETSHR

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
EP-2336242-B1 Mixture of conjugated diene - vinyl aromatic hydrocarbon copolymers and adhesive composition having the same TSRC CORP (TW) 2016-08-03 EP disclosed
US-8461246-B2 Mixture of conjugated diene—vinyl aromatic hydrocarbon copolymers and adhesive composition having the same TSRC CORPORATION (TW) 2013-06-11 US disclosed
US-20110152436-A1 MIXTURE OF CONJUGATED DIENE - VINYL AROMATIC HYDROCARBON COPOLYMERS AND ADHESIVE COMPOSITION HAVING THE SAME TSRC CORPORATION (TW) 2011-06-23 US disclosed
EP-2336242-A1 Mixture of conjugated diene - vinyl aromatic hydrocarbon copolymers and adhesive composition having the same TSRC Corporation (TW) 2011-06-22 EP disclosed
US-20050215709-A1 Conjugated diene-vinyl aromatic hydrocarbon copolymer containing siloxane compound for promoting abrasive resistance TSRC CORPORATION 2005-09-29 US disclosed