SCHEMBL7051403

SCHEMBL7051403

C[C@H]1C(=O)C=CN2c3ccc(Cl)cc3CC[C@@H]12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 17/20 1.00
NOTUM Q6P988 2/20 0.43
SRD5A2 P31213 2/20 0.42
HSD17B3 P37058 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
SCHEMBL6944630 1.00 SRD5A1 (1.00) SRD5A1NOTUMSRD5A2HSD17B3
SCHEMBL7050013 0.85 SRD5A1 (1.00) SRD5A1NOTUM
SCHEMBL6945153 0.85 SRD5A1 (1.00) SRD5A1NOTUM
SCHEMBL6945939 0.81 SRD5A1 (1.00) SRD5A1NOTUMHSD17B3
SCHEMBL7052742 0.81 SRD5A1 (1.00) SRD5A1NOTUMHSD17B3
SCHEMBL6943973 0.81 SRD5A1 (1.00) SRD5A1NOTUMHSD17B3
SCHEMBL6945937 0.81 SRD5A1 (1.00) SRD5A1NOTUMHSD17B3
SCHEMBL6943997 0.73 SRD5A1 (1.00) SRD5A1NOTUMHSD17B3
SCHEMBL20344483 0.67 SRD5A1 (0.50) SRD5A1NOTUMSRD5A2
SCHEMBL15964553 0.64 AADAT (0.50) SRD5A1NOTUMSRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0999747-B1 USE OF BENZO[C]QUINOLIZINE DERIVATIVES AS PLANT GROWTH REGULATORS APPLIED RESEARCH SYSTEMS (AN) 2003-04-23 EP claimed