SCHEMBL7515567

SCHEMBL7515567

O=C(c1cn(C(CC2CCNCC2)c2cnc[nH]2)cc1-c1cccc2ccccc12)N1CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.58
FNTB P49356 10/20 0.58
PGGT1B P53609 1/20 0.43
HTR2C P28335 7/20 0.40
PIK3CD O00329 1/20 0.38
PIK3R2 O00459 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
PIK3R5 Q8WYR1 1/20 0.38
PIK3R3 Q92569 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL7503755 0.91 FNTA (0.56) FNTAFNTBPGGT1BHTR2CPIK3CD
SCHEMBL7505597 0.89 FNTA (0.54) FNTAFNTBPGGT1BHTR2CPIK3CD
SCHEMBL6927874 0.87 FNTA (0.53) FNTAFNTBPGGT1BHTR2CPIK3CD
SCHEMBL7509425 0.87 FNTA (0.52) FNTAFNTBPGGT1BHTR2CMEN1
SCHEMBL27500777 0.85 FNTA (0.62) FNTAFNTBPGGT1BHTR2CMEN1
SCHEMBL7084118 0.84 FNTA (0.62) FNTAFNTBPGGT1BHTR2CALDH1A1
SCHEMBL7512901 0.79 FNTA (0.45) FNTAFNTBPGGT1BHTR2C
SCHEMBL6977268 0.79 FNTA (0.59) FNTAFNTBPGGT1BHTR2CKMT2A
SCHEMBL6979050 0.78 FNTA (0.59) FNTAFNTBPGGT1BHTR2CMEN1
SCHEMBL7648941 0.78 FNTA (0.59) FNTAFNTBPGGT1BHTR2CMEN1

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
EP-1058683-B1 FARNESYL TRANSFERASE INHIBITORS HAVING A PIPERIDINE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD (KR) 2002-12-04 EP claimed