SCHEMBL3071699

SCHEMBL3071699

OC(=S)NN1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.42
CA1 P00915 7/20 0.36
CA2 P00918 7/20 0.36
CA12 O43570 6/20 0.36
CA9 Q16790 6/20 0.36
ALDH1A1 P00352 3/20 0.35
MGLL Q99685 2/20 0.35
PIN1 Q13526 1/20 0.35
PHGDH O43175 1/20 0.35
ALDH2 P05091 1/20 0.35
FBP1 P09467 1/20 0.35
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 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
SCHEMBL10897991 1.00 HTT (0.42) HTTCA1CA2CA12CA9
SCHEMBL28146447 0.97 HTT (0.41) HTTCA1CA2CA12CA9
SCHEMBL3074808 0.97
Ammonia Solution, Strong SCHEMBL4747013 0.94 ALDH1A1 (0.38) HTTCA1CA2CA12CA9
SCHEMBL3074878 0.93 HTT (0.38) HTTCA1CA2CA12CA9
SCHEMBL6515029 0.91 HTT (0.37) HTTCA1CA2CA12CA9
SCHEMBL3066005 0.90 HTT (0.35) HTTCA1CA2CA12CA9
SCHEMBL7758216 0.87 HTT (0.34) HTTCA1CA2CA12CA9
Ammonia Solution, Strong SCHEMBL28405557 0.87 HTT (0.34) HTTCA1CA2CA12CA9
Piperidine SCHEMBL11695430 0.87 ALDH1A1 (0.38) HTTCA2ALDH1A1L3MBTL1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109642074-A Crosslinkable rubber composition, crosslinked rubber product, and conductive member 日本瑞翁株式会社 2019-04-16 CN disclosed
CN-108350182-A The manufacturing method and tire manufacturing method of rubber composition for tire 住友橡胶工业株式会社 2018-07-31 CN disclosed
CN-105017571-B Safety tread is inserted into rubber composition and the tire manufactured using it with side wall 韩国轮胎株式会社 2018-05-25 CN disclosed
US-7833331-B2 Non-toxic corrosion-protection pigments based on cobalt UNIVERSITY OF DAYTON (US) 2010-11-16 US disclosed
US-7789958-B2 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON (US) 2010-09-07 US disclosed
US-20090163628-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON COBALT STURGILL JEFFREY ALLEN 2009-06-25 US disclosed
US-7422793-B2 Non-toxic corrosion-protection rinses and seals based on rare earth elements UNIVERSITY OF DAYTON (US) 2008-09-09 US disclosed
US-7407711-B2 Non-toxic corrosion-protection conversion coats based on rare earth elements UNIVERSITY OF DAYTON (US) 2008-08-05 US disclosed
US-7294211-B2 Non-toxic corrosion-protection conversion coats based on cobalt UNIVERSITY OF DAYTON (US) 2007-11-13 US disclosed
US-7291217-B2 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON (US) 2007-11-06 US disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
US-20040104377-A1 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON 2004-06-03 US disclosed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed