SCHEMBL6436279

SCHEMBL6436279

CC1=C2CCC3CCCCC3N2CCC1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
SRD5A1 P18405 6/20 0.33
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
BRCA1 P38398 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL6432235 0.81 SRD5A1 (0.32) ALDH1A1SRD5A1
SCHEMBL6430811 0.80
SCHEMBL6431534 0.74 SRD5A1 (0.35) SRD5A1MEN1MAPTBRCA1KMT2A
SCHEMBL6434510 0.73 ALDH1A1 (0.37) ALDH1A1SRD5A1KMT2A
SCHEMBL6432674 0.71 PSEN1 (0.31)
SCHEMBL6435838 0.67 SRD5A1 (0.48) ALDH1A1SRD5A1MAPTKMT2A
SCHEMBL6430969 0.67 SRD5A1 (0.31) SRD5A1
SCHEMBL6431384 0.65 SRD5A1 (0.33) SRD5A1
SCHEMBL23845132 0.61 SRD5A1 (0.41) ALDH1A1SRD5A1
SCHEMBL6431921 0.60 ALDH1A1 (0.37) ALDH1A1SRD5A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066284-B1 BENZO(C)QUINOLIZINE DERIVATIVES AND THEIR USE AS 5 ALPHA-REDUCTASES INHIBITORS APPLIED RESEARCH SYSTEMS (AN) 2005-08-31 EP claimed
EP-0926148-A1 Benzo (C)quinolizine derivatives, their preparation and use as 5-alphareductases inhibitors APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 1999-06-30 EP claimed
US-6962925-B1 Benzo(C)quinolizine derivatives and their use as 5α-reductases inhibitors APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-11-08 US disclosed
EP-1066284-B1 BENZO(C)QUINOLIZINE DERIVATIVES AND THEIR USE AS 5 ALPHA-REDUCTASES INHIBITORS APPLIED RESEARCH SYSTEMS (AN) 2005-08-31 EP disclosed
EP-0926148-A1 Benzo (C)quinolizine derivatives, their preparation and use as 5-alphareductases inhibitors APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 1999-06-30 EP disclosed