SCHEMBL2935482

SCHEMBL2935482

CSc1ccccc1NC(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.68
MEN1 O00255 4/20 0.68
ALDH1A1 P00352 5/20 0.58
MAPT P10636 4/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
TP53 P04637 2/20 0.57
HSD17B10 Q99714 2/20 0.57
POLB P06746 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57
RAB9A P51151 3/20 0.56
NPC1 O15118 2/20 0.56
LMNA P02545 1/20 0.56
MAPK1 P28482 1/20 0.56
TSHR P16473 1/20 0.54
ALOX15 P16050 1/20 0.54
CASP1 P29466 1/20 0.54
CASP7 P55210 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HPGD P15428 1/20 0.53

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
SCHEMBL6857302 0.85 KMT2A (0.65) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4938228 0.83 KMT2A (0.62) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL27665991 0.83 KMT2A (0.62) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL29651063 0.83 KMT2A (0.62) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4210466 0.83 KMT2A (0.62) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL28189189 0.82 KMT2A (0.76) KMT2AMEN1ALDH1A1MAPTTP53
SCHEMBL3690292 0.82 TDP1 (0.50) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL10351900 0.81 CETP (0.53) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4654049 0.80 TDP1 (0.72) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8350627 0.80 SMN1; SMN2 (0.70) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1353926-B1 MIKANOLIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USES SOD CONSEILS RECH APPLIC (FR) 2006-03-08 EP claimed
JP-2004533456-A 2004-11-04 JP claimed
EP-1438039-A2 PRODUCT COMPRISING MIKANOLIDE, DIHYDROMIKANOLIDE OR AN ANALOGUE THEREOF COMBINED WITH ANOTHER ANTI-CANCER AGENT FOR THERAPEUTIC USE IN CANCER TREATMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-07-21 EP claimed
WO-2002096348-A2 PRODUCT COMPRISING MIKANOLIDE, DIHYDROMIKANOLIDE OR AN ANALOGUE THEREOF COMBINED WITH ANOTHER ANTI-CANCER AGENT FOR THERAPEUTIC USE IN CANCER TREATMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2002-12-05 WO claimed
EP-2229391-A1 PYRIDO[2,3-B]PYRAZINE-8-SUBSTITUTED COMPOUNDS AND THEIR USE Cancer Research Technology Limited (GB) 2010-09-22 EP disclosed
WO-2009077766-A1 PYRIDO[2,3-B]PYRAZINE-8-SUBSTITUTED COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-06-25 WO disclosed
EP-1353926-B1 MIKANOLIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USES SOD CONSEILS RECH APPLIC (FR) 2006-03-08 EP disclosed
EP-1438039-A2 PRODUCT COMPRISING MIKANOLIDE, DIHYDROMIKANOLIDE OR AN ANALOGUE THEREOF COMBINED WITH ANOTHER ANTI-CANCER AGENT FOR THERAPEUTIC USE IN CANCER TREATMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-07-21 EP disclosed
WO-2002096348-A2 PRODUCT COMPRISING MIKANOLIDE, DIHYDROMIKANOLIDE OR AN ANALOGUE THEREOF COMBINED WITH ANOTHER ANTI-CANCER AGENT FOR THERAPEUTIC USE IN CANCER TREATMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2002-12-05 WO disclosed
EP-0008177-B1 VULCANIZABLE RUBBER COMPOSITIONS CONTAINING SUBSTITUTED CARBAMIC ACID ESTERS MONSANTO COMPANY (US) 1981-08-26 EP disclosed
EP-0008177-A1 Vulcanizable rubber compositions containing substituted carbamic acid esters MONSANTO COMPANY (US) 1980-02-20 EP disclosed
US-4156680-A Scorch inhibited vulcanizable rubber compositions containing carbamic acid esters MONSANTO COMPANY (US) 1979-05-29 US disclosed