SCHEMBL9026591

SCHEMBL9026591

CC(C[O])Cc1ccc(Br)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.42
EPHX1 P07099 2/20 0.41
KMT2A Q03164 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MME P08473 3/20 0.40
PYCR1 P32322 1/20 0.38
TAAR1 Q96RJ0 2/20 0.38

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
SCHEMBL6771848 0.80 SIGMAR1 (0.41) ACACBEPHX1KMT2ASIGMAR1MEN1
SCHEMBL3007047 0.79 MME (0.41) ACACBEPHX1KMT2ASIGMAR1MEN1
SCHEMBL9284510 0.78 ACACB (0.42) ACACBEPHX1KMT2ASIGMAR1MEN1
SCHEMBL10823884 0.78 SIGMAR1 (0.40) ACACBEPHX1KMT2ASIGMAR1MEN1
SCHEMBL10041 0.78 ACACB (0.42) ACACBEPHX1KMT2ASIGMAR1MEN1
SCHEMBL17393790 0.78 TAAR1 (0.46) ACACBEPHX1SIGMAR1PYCR1TAAR1
SCHEMBL94628 0.77 TAAR1 (0.54) EPHX1KMT2ASIGMAR1MEN1NPC1
SCHEMBL1437577 0.77 CHRM1 (0.47) EPHX1SIGMAR1MME
SCHEMBL1699496 0.76 MME (0.49) ACACBEPHX1KMT2AMEN1NPC1
SCHEMBL22236136 0.76 ACACB (0.49) ACACBEPHX1KMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed
US-5459142-A Autoimmune disease, atherosclerosis, antiischemic agents and nephritis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-10-17 US disclosed
EP-0511879-B1 Pyrazine derivatives OTSUKA PHARMA CO LTD (JP) 1995-03-22 EP disclosed
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0511879-A1 Pyrazine derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-04 EP disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed