SCHEMBL8919255

SCHEMBL8919255

CCOC(=O)c1cc2c(c(OC)c1)NC(=O)CC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 1/20 0.47
UBE2N P61088 1/20 0.44
CASP6 P55212 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.39
KDM4E B2RXH2 2/20 0.39
PKM P14618 1/20 0.39
SRD5A1 P18405 1/20 0.39

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
SCHEMBL18031229 0.87 CRBN (0.48) TDP1L3MBTL1LMNASMN1; SMN2CA12
SCHEMBL22411387 0.83 SRD5A1 (0.42) TDP1L3MBTL1LMNASMN1; SMN2NPC1
SCHEMBL11123134 0.82 LMNA (0.47) TDP1L3MBTL1LMNASMN1; SMN2MAPK1
SCHEMBL8920608 0.82 CA12 (0.47) TDP1L3MBTL1LMNARAB9ACA12
SCHEMBL11120527 0.81 NR3C1 (0.38) TDP1L3MBTL1KMT2AMEN1KDM4E
SCHEMBL18033416 0.80 HSD17B2 (0.47) HSD17B2UBE2NCASP6TDP1L3MBTL1
SCHEMBL22412138 0.79 KMT2A (0.46) LMNASMN1; SMN2NPC1RAB9ACA12
SCHEMBL22411409 0.78 ALOX15 (0.51) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL14642141 0.76 CYP11B1 (0.41) L3MBTL1NPC1CA9
SCHEMBL7294192 0.75 CRBN (0.56) L3MBTL1CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5591751-A CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-07 US disclosed
EP-0636128-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP disclosed
WO-1994019339-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed