SCHEMBL7701639

SCHEMBL7701639

O=C1CC(c2ccccc2)c2cc(C(=O)c3ccc(Cl)cc3)ccc2N1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.51
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ATM Q13315 1/20 0.47
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.45
MAPT P10636 1/20 0.43
GPBAR1 Q8TDU6 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL11947177 0.93 MAPK1 (0.48) TP53MEN1KMT2ALMNAMAPK1
SCHEMBL1538402 0.91 LMNA (0.58) TP53MEN1KMT2AATMLMNA
SCHEMBL30006499 0.91 LMNA (0.58) TP53MEN1KMT2AATMLMNA
SCHEMBL6863006 0.80 TP53 (0.50) TP53MEN1KMT2AATMLMNA
SCHEMBL5657981 0.80 LMNA (0.53) TP53MEN1KMT2ALMNAMAPT
SCHEMBL14094469 0.79 ATM (0.39) MEN1KMT2AATMMAPK1ALDH1A1
SCHEMBL880275 0.79 TP53 (0.57) TP53MEN1KMT2AATMLMNA
SCHEMBL880444 0.76 TP53 (0.59) TP53MEN1KMT2ALMNAMAPK1
SCHEMBL4371172 0.74 TP53 (0.55) TP53MEN1KMT2AATMLMNA
SCHEMBL12559670 0.74 TDP1 (0.57) TP53MEN1KMT2AATMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019395-B1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2002-01-30 EP disclosed
EP-1106610-A1 Farnesyl transferase inhibiting 2-quinolone derivatives Janssen Pharmaceutica N.V. (BE) 2001-06-13 EP disclosed
EP-1019395-A1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2000-07-19 EP disclosed
US-5968952-A ANTITUMOR AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1999-10-19 US disclosed
WO-1997016443-A1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1997-05-09 WO disclosed