SCHEMBL1648557

SCHEMBL1648557

Brc1ccccc1CCSSCCc1ccccc1Br

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.58
IDO1 P14902 2/20 0.45
GPR52 Q9Y2T5 1/20 0.40
TSHR P16473 2/20 0.38
CYP2A13 Q16696 1/20 0.37
LMNA P02545 2/20 0.36
PYCR1 P32322 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
NFKB1 P19838 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTR7 P34969 1/20 0.34
BLM P54132 1/20 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
SCHEMBL29351396 0.82 TAAR1 (0.71) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL6738136 0.82 TAAR1 (0.71) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL216488 0.75 TAAR1 (0.62) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL30584986 0.75 TAAR1 (0.62) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL9194773 0.74 NOS1 (0.59) TAAR1IDO1LMNACYP2D6BLM
SCHEMBL286557 0.73 TAAR1 (0.60) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL4861130 0.73 TAAR1 (0.60) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL4965401 0.73 TAAR1 (0.60) TAAR1IDO1GPR52TSHRCYP2A13
SCHEMBL29423333 0.73 TAAR1 (1.00) TAAR1IDO1GPR52CYP2A13CYP1A2
SCHEMBL1047251 0.73 TAAR1 (0.60) TAAR1IDO1GPR52TSHRCYP2A13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426526-B2 Solid golf ball SRI SPORTS LIMITED (JP) 2013-04-23 US disclosed
US-20110086727-A1 SOLID GOLF BALL SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2011-04-14 US disclosed