SCHEMBL6819781

SCHEMBL6819781

CC1Cc2cc(Cl)ccc2N2CCC(=O)C=C12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 17/20 1.00
NOTUM Q6P988 2/20 0.43
AADAT Q8N5Z0 1/20 0.40

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
SCHEMBL6820284 0.85 SRD5A1 (0.74) SRD5A1NOTUMAADAT
SCHEMBL6820470 0.81 SRD5A1 (0.67) SRD5A1NOTUM
SCHEMBL6819931 0.77 SRD5A1 (0.63) SRD5A1
SCHEMBL6820051 0.77 SRD5A1 (0.64) SRD5A1NOTUMAADAT
SCHEMBL6820055 0.75 SRD5A1 (1.00) SRD5A1NOTUM
SCHEMBL6819849 0.74 SRD5A1 (1.00) SRD5A1
SCHEMBL6820075 0.73 SRD5A1 (1.00) SRD5A1NOTUM
SCHEMBL6820238 0.65 SRD5A1 (0.62) SRD5A1
SCHEMBL6823141 0.64 SRD5A1 (1.00) SRD5A1NOTUM
SCHEMBL28995163 0.63 ALDH1A1 (0.49) SRD5A1AADAT

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