SCHEMBL6820051

SCHEMBL6820051

CC1Cc2cc(Cl)ccc2N2C1=CC(=O)CC2C

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 15/20 0.64
NOTUM Q6P988 1/20 0.50
ROCK1 Q13464 1/20 0.45
AADAT Q8N5Z0 1/20 0.41
CYP11B2 P19099 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
SCHEMBL6823140 0.80 NOTUM (0.45) SRD5A1NOTUMROCK1
SCHEMBL6823141 0.78 SRD5A1 (1.00) SRD5A1NOTUMROCK1
SCHEMBL6822962 0.78 SRD5A1 (0.54) SRD5A1NOTUMROCK1CYP11B2
SCHEMBL6819781 0.77 SRD5A1 (1.00) SRD5A1NOTUMAADAT
SCHEMBL6820138 0.73 SRD5A1 (0.64) SRD5A1NOTUMROCK1
SCHEMBL6942300 0.67 NOTUM (0.59) SRD5A1NOTUM
SCHEMBL10922013 0.66 SRD5A1 (0.45) SRD5A1NOTUMROCK1AADAT
SCHEMBL28995163 0.64 ALDH1A1 (0.49) SRD5A1AADAT
SCHEMBL30489354 0.64 ALDH1A1 (0.49) SRD5A1AADAT
SCHEMBL29404958 0.63 METAP1 (0.56) SRD5A1CYP11B2

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