SCHEMBL8934701

SCHEMBL8934701

Cc1cccc(C(N)c2cccc(NC[C@@H](N)CS)c2)c1C.Cc1cccc(NC(=O)c2cccc(CNC[C@@H](N)CS)c2)c1C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.44
FNTB P49356 7/20 0.44
PGGT1B P53609 7/20 0.44
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ATM Q13315 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
DDR2 Q16832 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 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
SCHEMBL8934699 1.00 FNTA (0.44) FNTAFNTBPGGT1BMAPTLMNA
SCHEMBL8934700 0.88 FNTA (0.48) FNTAFNTBPGGT1BMAPTLMNA
SCHEMBL7994759 0.86 FNTA (0.56) FNTAFNTBPGGT1BMAPTLMNA
SCHEMBL7996862 0.86 FNTA (0.56) FNTAFNTBPGGT1BMAPTLMNA
Hydrochloric Acid SCHEMBL8000351 0.85 FNTA (0.55) FNTAFNTBPGGT1BMAPTLMNA
Hydrochloric Acid SCHEMBL7994749 0.85 FNTA (0.55) FNTAFNTBPGGT1BMAPTLMNA
SCHEMBL7993175 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPTLMNA
SCHEMBL7993171 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPTLMNA
SCHEMBL7995119 0.83 FNTA (0.48) FNTAFNTBPGGT1BMAPTLMNA
Hydrochloric Acid SCHEMBL7982918 0.82 FNTA (0.47) FNTAFNTBPGGT1BMAPTLMNA

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-1996030014-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO claimed
WO-1996030014-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-10-03 WO disclosed