SCHEMBL9502356

SCHEMBL9502356

CCOP(=O)(Cc1ccc(C(=O)Nc2ccc(Br)cc2)cc1)OCC

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
TP53 P04637 1/20 0.54
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
NPC1 O15118 1/20 0.48
HDAC1 Q13547 1/20 0.47
FPR2 P25090 4/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.46

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
SCHEMBL9499648 0.88 NPC1 (0.59) MAPTKMT2AMEN1NPC1HDAC1
SCHEMBL9502383 0.87 HDAC1 (0.50) MAPTTP53NPC1HDAC1KDM4E
SCHEMBL7164864 0.87 NPC1 (0.52) MAPTKMT2AMEN1NPC1HDAC1
SCHEMBL9500932 0.87 RAB9A (0.58) MAPTKMT2AMEN1NPC1HDAC1
SCHEMBL8537002 0.86 TRPV1 (0.58) KMT2AMEN1NPC1HDAC1ALDH1A1
SCHEMBL9500132 0.86 NPC1 (0.65) MAPTTP53KMT2AMEN1NPC1
SCHEMBL9499536 0.85 TRPV1 (0.57) MAPTNPC1HDAC1FPR2SMN1; SMN2
SCHEMBL9500191 0.84 MLYCD (0.51) MAPTTP53KMT2AMEN1NPC1
SCHEMBL675546 0.83 KMT2A (0.42) KMT2AMEN1HDAC1FPR2GAA
SCHEMBL9499597 0.83 LMNA (0.66) MAPTKMT2AMEN1NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273444-B1 USE OF CARBOXAMIDE COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT FOR TREATING HYPERLIPIDEMIA OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1993-05-05 EP claimed
US-5081112-A Administering an aryl phosphonate carboxamide OTSUKA PHARMACEUTICAL FACTORY INC. (JP) 1992-01-14 US claimed
US-4822780-A CALCIUM ANTAGONIST, ANTIINFLAMMATORY AGENT OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1989-04-18 US claimed
EP-0273444-A2 Use of carboxamide compounds for the preparation of a medicament for treating hyperlipidemia OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1988-07-06 EP claimed
EP-0273444-B1 USE OF CARBOXAMIDE COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT FOR TREATING HYPERLIPIDEMIA OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1993-05-05 EP disclosed
US-5081112-A Administering an aryl phosphonate carboxamide OTSUKA PHARMACEUTICAL FACTORY INC. (JP) 1992-01-14 US disclosed
EP-0273444-A2 Use of carboxamide compounds for the preparation of a medicament for treating hyperlipidemia OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1988-07-06 EP disclosed