SCHEMBL3802207

SCHEMBL3802207

CN/C(N)=C/C(=O)Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.52
▸ CYP1A2 P05177 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ DEGS1 O15121 1/20 0.47
▸ MAOB P27338 2/20 0.47
▸ MMP1 P03956 2/20 0.47
▸ MMP2 P08253 2/20 0.47
▸ MMP9 P14780 2/20 0.47
▸ EGFR P00533 1/20 0.47
▸ MAOA P21397 1/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ NAPRT Q6XQN6 1/20 0.47
▸ PARP1 P09874 3/20 0.47
▸ PARP10 Q53GL7 3/20 0.47
▸ PARP15 Q460N3 1/20 0.47
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ TSHR P16473 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 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
SCHEMBL3802208 1.00 TGM2 (0.52) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL10666505 0.81 NAPRT (0.55) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL8263524 0.81 NAPRT (0.55) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL5177141 0.79 PARP1 (0.57) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL5174574 0.77 TGM2 (0.50) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL5174576 0.77 TGM2 (0.50) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL7679084 0.77 SMN1; SMN2 (0.67) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL396577 0.77 SMN1; SMN2 (0.67) TGM2CYP1A2NPSR1DEGS1MAOB
SCHEMBL21977094 0.76 TAS2R38 (0.40) CYP1A2NPSR1HSD17B10NAPRTGAA
SCHEMBL5176510 0.76 MAOB (0.61) TGM2CYP1A2NPSR1MAOBMMP1

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-7833331-B2 Non-toxic corrosion-protection pigments based on cobalt UNIVERSITY OF DAYTON (US) 2010-11-16 — — US disclosed
US-20090163628-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON COBALT STURGILL JEFFREY ALLEN 2009-06-25 — — US disclosed
Send feedback