SCHEMBL3071119

SCHEMBL3071119

O=C(CC(=S)Nc1ccccc1)Nc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.58
▸ EPHX2 P34913 2/20 0.57
▸ KDM1A O60341 1/20 0.56
▸ MAPT P10636 3/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ HDAC4 P56524 4/20 0.53
▸ HDAC1 Q13547 4/20 0.53
▸ HDAC7 Q8WUI4 4/20 0.53
▸ HDAC11 Q96DB2 4/20 0.53
▸ HDAC8 Q9BY41 4/20 0.53
▸ HDAC6 Q9UBN7 4/20 0.53
▸ HDAC9 Q9UKV0 4/20 0.53
▸ HDAC5 Q9UQL6 4/20 0.53
▸ HDAC3 O15379 3/20 0.53
▸ HDAC2 Q92769 3/20 0.53
▸ HDAC10 Q969S8 3/20 0.53
▸ MAOB P27338 1/20 0.53
▸ CYP3A4 P08684 2/20 0.52
▸ TP53 P04637 1/20 0.52

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
SCHEMBL1689206 0.84 EPHX2 (0.68) EPHX2KDM1AMAPTL3MBTL1HTT
SCHEMBL3071122 0.84 HSD17B10 (0.64) ALDH1A1EPHX2MAPTMAOBCYP3A4
SCHEMBL28051723 0.83 KDM1A (0.67) ALDH1A1EPHX2KDM1AMAPTL3MBTL1
SCHEMBL9235727 0.83 HDAC4 (0.61) ALDH1A1EPHX2KDM1AMAPTL3MBTL1
SCHEMBL3062252 0.82 MAPT (0.58) ALDH1A1EPHX2MAPTHTTCYP3A4
SCHEMBL3069525 0.82 ALDH1A1 (0.57) ALDH1A1EPHX2KDM1AMAPTL3MBTL1
SCHEMBL11677100 0.82 MAPT (0.62) ALDH1A1EPHX2KDM1AMAPTL3MBTL1
SCHEMBL175602 0.80 EPHX2 (0.63) EPHX2KDM1AMAPTL3MBTL1HTT
SCHEMBL27538195 0.80 EPHX2 (0.63) EPHX2KDM1AMAPTL3MBTL1HTT
SCHEMBL9129270 0.80 KMT2A (0.59) ALDH1A1EPHX2MAPTL3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20070149673-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE STURGILL JEFFREY A 2007-06-28 — — US disclosed
US-7235142-B2 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON (US) 2007-06-26 — — US 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
Send feedback