SCHEMBL3068166

SCHEMBL3068166

NC(=O)NNCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
CYP2C19 P33261 1/20 0.48
LMNA P02545 1/20 0.47
PTGS2 P35354 1/20 0.47
IDO1 P14902 2/20 0.46
THRB P10828 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
GAA P10253 1/20 0.46
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44

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
SCHEMBL7459801 0.93 PLA2G10 (0.55) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL4985848 0.84 OPRM1 (0.51) LMNACYP3A4
SCHEMBL1653407 0.83 CYP1A2 (0.54) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL24847549 0.83 CYP1A2 (0.54) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL6835354 0.81 ALDH1A1 (0.46) CYP2D6CYP2C9TSHRPTGS2NPC1
SCHEMBL8652161 0.80 ALDH1A1 (0.50) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL10682559 0.80 SMN1; SMN2 (0.49) CYP2C9CYP2C19LMNATHRBNPC1
SCHEMBL294698 0.80 IDO1 (0.48) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL21776624 0.80 LMNA (0.49) CYP2C9TSHRCYP2C19LMNANPC1
SCHEMBL26547106 0.80 TGM2 (0.47) CYP2C9CYP2C19IDO1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108368133-A Urea peptidomimetic boronic acid compounds and its pharmaceutical composition, preparation method and purposes 北京大学 2018-08-03 CN claimed
CN-106588965-A Urea peptidomimetic boric acid compound as well as pharmaceutical composition, preparation method and application thereof 北京大学 2017-04-26 CN claimed
CN-108929340-A Proline boric acid compound and its preparation method and application 北京大学 2018-12-04 CN disclosed
CN-106588965-A Urea peptidomimetic boric acid compound as well as pharmaceutical composition, preparation method and application thereof 北京大学 2017-04-26 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
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
US-5279920-A Containing a hydrazide compound KONICA CORPORATION (JP) 1994-01-18 US disclosed
EP-0539925-A1 Silver halide photographic light sensitive material KONICA CORPORATION (JP) 1993-05-05 EP disclosed
US-5126444-A Antibiotics IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-06-30 US disclosed
US-5064824-A CEPHALOSPORIN COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-11-12 US disclosed
EP-0341910-A2 Cephalosporins, process for their preparation, intermediates and pharmaceutical compositions ZENECA LIMITED (GB) 1989-11-15 EP disclosed