SCHEMBL19915591

SCHEMBL19915591

ClCc1ncc2cc(Cl)ccc2c1-c1cncnc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP17A1 P05093 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ CYP11B1 P15538 2/20 0.32
▸ CYP11B2 P19099 2/20 0.32
▸ ADK P55263 1/20 0.32
▸ PDGFRB P09619 1/20 0.31
▸ PDGFRA P16234 1/20 0.31
▸ CYP2D6 P10635 1/20 0.30
▸ ACLY P53396 1/20 0.30
▸ CSNK2A2 P19784 1/20 0.30
▸ CSNK2B P67870 1/20 0.30

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
SCHEMBL19915556 0.84 ADK (0.33) ADK
SCHEMBL19915693 0.78 — —
SCHEMBL19923341 0.66 WNT3A (0.34) —
SCHEMBL18425754 0.65 NOS1 (0.33) —
SCHEMBL19899676 0.62 TDP1 (0.43) CYP11B1CYP11B2
SCHEMBL22966311 0.61 CSNK2A2 (0.39) PDGFRBPDGFRACSNK2A2CSNK2B
SCHEMBL3637489 0.60 CYP2A6 (0.43) PDGFRBPDGFRA
SCHEMBL18464844 0.60 POLB (0.42) CYP3A4
SCHEMBL31263625 0.60 NOS1 (0.40) PDGFRBPDGFRA
SCHEMBL6975325 0.59 CRHR1 (0.46) —

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
WO-2018038667-A1 RESPIRATORY SYNCYTIAL VIRUS INHIBITORS MEDIVIR AB (SE) 2018-03-01 — — WO disclosed
Send feedback