SCHEMBL6928525

SCHEMBL6928525

CCO[PH](=O)OCC.Nc1cc2c[c]c(=O)[nH]c2cc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.35
PARP1 P09874 1/20 0.34

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
SCHEMBL6937176 0.85 PARP1 (0.40) ARPARP1
SCHEMBL6923608 0.84 CA1 (0.36)
SCHEMBL6928802 0.82 TRPV4 (0.30)
Phosphonic Acid SCHEMBL7070319 0.68 CA1 (0.41)
SCHEMBL6935418 0.67 CA2 (0.46) AR
SCHEMBL6594763 0.66 L3MBTL1 (0.49) PARP1
SCHEMBL6928527 0.66 PARP1 (0.40) ARPARP1
SCHEMBL6935736 0.65 CNR2 (0.37) AR
SCHEMBL6938290 0.65 CNR2 (0.36) AR
SCHEMBL6932417 0.64 CA12 (0.49) ARPARP1

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
US-6518258-B1 6-sulphamoyl -3-quinolyphosphonic acid compounds LES LABORATOIRES SERVIER (FR) 2003-02-11 US disclosed