SCHEMBL11458282

SCHEMBL11458282

C1=CC2=Cc3ccccc3CNC2C=C1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.36
PRCP P42785 1/20 0.31
PNMT P11086 4/20 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
SCHEMBL2643485 0.71 GAA (0.33)
SCHEMBL6302024 0.69 KDM1A (0.36)
SCHEMBL8909200 0.69
SCHEMBL757569 0.69
SCHEMBL342296 0.67 ANPEP (0.38)
SCHEMBL5531635 0.67 TNKS2 (0.36) PARP1
SCHEMBL460544 0.61 GAA (0.36)
SCHEMBL22317589 0.61
SCHEMBL1040558 0.61
SCHEMBL1664032 0.61 HTR6 (0.32)

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-4230703-A ANALGESICS; ANTIINFLAMMATORY AGENTS TEIKOKU HORMONE MFG. CO., LTD. (JP) 1980-10-28 US disclosed