SCHEMBL17295282

SCHEMBL17295282

COc1cc(CCCN(Cc2cncn2C)c2cnc(C#N)cn2)ccc1-c1ccccc1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 8/20 0.39
▸ FNTB P49356 8/20 0.39
▸ PGGT1B P53609 6/20 0.39
▸ CHEK1 O14757 3/20 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
SCHEMBL17295284 0.91 FNTA (0.41) FNTAFNTBPGGT1B
SCHEMBL17295546 0.90 FNTA (0.43) FNTAFNTBPGGT1B
SCHEMBL17301808 0.88 FNTA (0.42) FNTAFNTBPGGT1B
SCHEMBL17295256 0.87 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL17295387 0.84 FNTA (0.42) FNTAFNTBPGGT1B
SCHEMBL17295221 0.84 FNTA (0.40) FNTAFNTBPGGT1B
SCHEMBL17301909 0.83 FNTA (0.38) FNTAFNTBPGGT1BCHEK1
SCHEMBL17295273 0.79 NSD2 (0.34) FNTAFNTBPGGT1B
SCHEMBL17295342 0.78 FNTA (0.44) FNTAFNTBPGGT1B
SCHEMBL17295383 0.77 FNTA (0.47) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015181272-A1 RAB GERANYLGERANYL TRANSFERASE INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2015-12-03 — — WO disclosed
WO-2015181272-A1 RAB GERANYLGERANYL TRANSFERASE INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2015-12-03 — — WO disclosed
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