SCHEMBL5562152

SCHEMBL5562152

CN1C(=O)NC(c2cccc(Cl)c2)c2cc(C(c3ccc(Cl)cc3)c3cncn3C)ccc21

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.52
FNTB P49356 10/20 0.52
BRD4 O60885 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
PGGT1B P53609 5/20 0.35
MDM2 Q00987 2/20 0.35
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
IDO1 P14902 1/20 0.33

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
SCHEMBL5555478 0.80 PDE4A (0.41) FNTAFNTBBRD4PDE4APDE4B
SCHEMBL5556337 0.80 PDE4A (0.41) FNTAFNTBBRD4PDE4APDE4B
SCHEMBL4371953 0.77 FNTA (0.47) FNTAFNTBPGGT1BMDM2
SCHEMBL4372100 0.75 FNTA (0.46) FNTAFNTBPGGT1BMDM2
SCHEMBL4372579 0.74 FNTA (0.49) FNTAFNTBPGGT1BMDM2IDO1
SCHEMBL4376761 0.73 FNTA (0.43) FNTAFNTBMDM2IDO1
SCHEMBL4377464 0.71 FNTA (0.45) FNTAFNTB
SCHEMBL13501471 0.71 FNTA (0.38) FNTAFNTBPGGT1B
SCHEMBL13899792 0.71 FNTA (0.38) FNTAFNTBPGGT1BMDM2
SCHEMBL5562507 0.69 BRD4 (0.40) FNTAFNTBBRD4PDE4APDE4B

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-0977750-B1 FARNESYLTRANSFERASE INHIBITING QUINAZOLINONES JANSSEN PHARMACEUTICA NV (BE) 2007-07-04 EP disclosed
US-6358961-B1 ADMINISTERING QUINAZOLINE DERIVATIVE FOR INHIBITING TUMOR GROWTH IN MAMMALS JANNSEN-CILAG S.A. (FR) 2002-03-19 US disclosed
US-6177432-B1 ANTICARCINOGENIC AGENTS, ANTITUMOR AGENTS JANSSEN-CILAG S.A. (FR) 2001-01-23 US disclosed
EP-0977750-A1 FARNESYLTRANSFERASE INHIBITING QUINAZOLINONES JANSSEN PHARMACEUTICA N.V. (BE) 2000-02-09 EP disclosed
WO-1998049157-A1 FARNESYLTRANSFERASE INHIBITING QUINAZOLINONES JANSSEN PHARMACEUTICA N.V. (BE) 1998-11-05 WO disclosed