SCHEMBL7652727

SCHEMBL7652727

COc1cc2nc(Cl)nc(N)c2c(OC(C)C)c1OC

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 2/20 0.38
PDE5A O76074 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.36
SRC P12931 1/20 0.36
DHFR P00374 1/20 0.35
CFD P00746 1/20 0.35

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
SCHEMBL11212954 0.89 PDE5A (0.43) SLC10A2PDE5AALDH1A1KDM4ESMN1; SMN2
SCHEMBL7652710 0.86 SLC10A2 (0.40) SLC10A2ALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL16689302 0.81 CFD (0.47) PDE5AALDH1A1KDM4ESMN1; SMN2DHFR
SCHEMBL6764928 0.79 ALDH1A1 (0.40) SLC10A2PDE5AALDH1A1KDM4ESMN1; SMN2
SCHEMBL16689309 0.79 CFD (0.45) SLC10A2PDE5AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6950219 0.77 PDGFRB (0.40) PDE5AALDH1A1KDM4ESMN1; SMN2DHFR
SCHEMBL4738100 0.74 PDE3A (0.50) ALDH1A1DHFR
SCHEMBL6765497 0.74 SLC10A2 (0.45) SLC10A2ALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL11209986 0.73 SMN1; SMN2 (0.45) SLC10A2ALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL7653476 0.72 SLC10A2 (0.40) SLC10A2ALDH1A1GAASRC

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
US-6417194-B1 TREATMENT OF BENIGN PROSTATIC HYPERPLASIA PFIZER, INC. 2002-07-09 US disclosed
US-6048864-A Quinolines and quinazolines useful in therapy PFIZER INC (US) 2000-04-11 US disclosed
EP-0887344-A1 Quinolines and quinazolines useful in therapy Pfizer Limited (GB) 1998-12-30 EP disclosed