SCHEMBL6580484

SCHEMBL6580484

CCOc1ccc(CSCc2ccc(OCC)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.64
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
MAPT P10636 2/20 0.49
LMNA P02545 2/20 0.49
ALOX12 P18054 1/20 0.49
PRSS1 P07477 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
LTA4H P09960 2/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ACE P12821 1/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.45

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
SCHEMBL23900923 0.91 NQO1 (0.58) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL11648275 0.85 NQO1 (0.50) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL11573046 0.85 NQO1 (0.50) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL11703514 0.83 NQO1 (0.48) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL27586168 0.83 NQO1 (0.58) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
1,4-Diethoxybenzene SCHEMBL124015 0.80 NQO1 (1.00) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
1,4-Diethoxybenzene SCHEMBL28186701 0.80 NQO1 (1.00) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL21788136 0.79 CYP2C19 (0.56) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL2644022 0.79 NQO1 (0.67) NQO1TSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL31423 0.78 NQO1 (0.74) NQO1TSHRTDP1SMN1; SMN2ALDH1A1

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
EP-1120435-B1 APPARATUS AND METHOD FOR PRODUCING RESIN TEIJIN LTD (JP) 2004-05-06 EP disclosed
US-6562936-B1 Resin excellent in hydrolysis and heat stability such as a reduction in molecular weight at the time of molding and color retention and moldability such as releasability and transferability, rarely experiences residence deterioration TEIJIN LIMITED (JP) 2003-05-13 US disclosed
US-6509435-B1 Heat resistance, stability; moldings TEIJIN LIMITED (JP) 2003-01-21 US disclosed
CN-1371399-A Polycarbonate, process for producing the same and molded article thereof TEIJIN LTD (JP) 2002-09-25 CN disclosed
EP-1191049-A1 POLYCARBONATE, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2002-03-27 EP disclosed
EP-1120435-A1 APPARATUS AND METHOD FOR PRODUCING RESIN TEIJIN LIMITED (JP) 2001-08-01 EP disclosed