SCHEMBL6618191

SCHEMBL6618191

O=C(O)c1ccc2c(c1)N(C(=O)c1cccc3ccccc13)CCN(C(=O)c1cccc3ccccc13)C2

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
FNTA P49354 11/20 0.47
FNTB P49356 11/20 0.47
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL6617854 0.83 FNTA (0.48) ALDH1A1LMNAFNTAFNTBUSP2
SCHEMBL3281222 0.83 MYC (0.53) ALDH1A1LMNAPOLBHTTKMT2A
SCHEMBL6619460 0.79 ALDH1A1 (0.48) ALDH1A1LMNAFNTAFNTBUSP2
SCHEMBL4453090 0.73 ALDH1A1 (0.77) ALDH1A1LMNAUSP2POLBHTT
SCHEMBL1263079 0.72 HDAC6 (0.66) ALDH1A1LMNA
SCHEMBL1263715 0.72 HDAC6 (0.59) ALDH1A1LMNA
SCHEMBL6615609 0.72 FNTA (0.50) ALDH1A1LMNAFNTAFNTBUSP2
SCHEMBL27478801 0.71 ALDH1A1 (0.46) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL3582934 0.71 ALDH1A1 (0.68) ALDH1A1LMNAUSP2POLBHTT
SCHEMBL3518475 0.70 ALDH1A1 (0.67) ALDH1A1LMNAUSP2POLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1481975-A1 Inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-01 EP disclosed
EP-0892797-A4 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2004-10-20 EP disclosed
US-6455523-B1 ADMINISTERING 1,4-BENZODIAZEPINE DERIVATIVE AS ANTITUMOR OR ANTICARCINOGENIC AGENT BRISTOL-MYERS SQUIBB COMPANY 2002-09-24 US disclosed
US-6011029-A BENZODIAZEPINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-01-04 US disclosed
EP-0892797-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-01-27 EP disclosed
WO-1997030992-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1997-08-28 WO disclosed