SCHEMBL17301808

SCHEMBL17301808

Cn1cncc1CN(CCCc1ccc(-c2ccccc2C(N)=O)cc1)c1cnc(C#N)cn1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 12/20 0.42
▸ FNTB P49356 12/20 0.42
▸ PGGT1B P53609 11/20 0.42
▸ LTB4R2 Q9NPC1 1/20 0.37

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
SCHEMBL17295342 0.91 FNTA (0.44) FNTAFNTBPGGT1B
SCHEMBL17295383 0.89 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL17295282 0.88 FNTA (0.39) FNTAFNTBPGGT1B
SCHEMBL17295207 0.85 FNTA (0.53) FNTAFNTBPGGT1B
SCHEMBL17295206 0.84 FNTA (0.43) FNTAFNTBPGGT1B
SCHEMBL17295300 0.81 FNTA (0.41) FNTAFNTBPGGT1BLTB4R2
SCHEMBL17295235 0.81 FNTA (0.42) FNTAFNTBPGGT1B
SCHEMBL17295151 0.81 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL17295165 0.81 FNTA (0.40) FNTAFNTBPGGT1BLTB4R2
SCHEMBL17301917 0.81 FNTA (0.42) 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 1 patent. 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
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