SCHEMBL6822962

SCHEMBL6822962

CC1C2=CC(=O)CC(C)N2c2ccc(Cl)cc2C1C

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 15/20 0.54
MAPT P10636 1/20 0.37
NOTUM Q6P988 1/20 0.35
ROCK1 Q13464 1/20 0.35
CYP11B2 P19099 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6815740 0.80 AADAT (0.38) SRD5A1NOTUM
SCHEMBL6820051 0.78 SRD5A1 (0.64) SRD5A1NOTUMROCK1CYP11B2
SCHEMBL6820138 0.78 SRD5A1 (0.64) SRD5A1MAPTNOTUMROCK1
SCHEMBL6819931 0.76 SRD5A1 (0.63) SRD5A1KMT2A
SCHEMBL6823141 0.70 SRD5A1 (1.00) SRD5A1NOTUMROCK1
SCHEMBL6823140 0.63 NOTUM (0.45) SRD5A1MAPTNOTUMROCK1
SCHEMBL6822967 0.61 SRD5A1 (0.64) SRD5A1
SCHEMBL6819781 0.61 SRD5A1 (1.00) SRD5A1NOTUM
SCHEMBL6819849 0.61 SRD5A1 (1.00) SRD5A1MAPT
SCHEMBL13242322 0.60 HTR2C (0.53) MEN1KMT2A

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
EP-1102765-B1 PROCESS FOR THE SYNTHESIS OF (1$i(H))-BENZO C]QUINOLIZIN-3-ONES DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2003-09-17 EP claimed
US-6723850-B1 N-ALKYLATION OF THE THIOAMIDE WITH A VINYL KETONE IN PRESENCE OF A STRONG BASE; 6-CHLORO-(1H)-3,4-DIHYDROQUINOLIN-2-THIONE REACTED WITH ETHYL VINYL KETONE APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-04-20 US disclosed
EP-1102765-B1 PROCESS FOR THE SYNTHESIS OF (1$i(H))-BENZO C]QUINOLIZIN-3-ONES DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2003-09-17 EP disclosed