SCHEMBL5555478

SCHEMBL5555478

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
MDM2 Q00987 7/20 0.41
BRD4 O60885 1/20 0.41
TP53 P04637 4/20 0.37
HTT P42858 2/20 0.37
FNTA P49354 2/20 0.37
FNTB P49356 2/20 0.37
SLC6A2 P23975 2/20 0.36
SLC6A3 Q01959 2/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA7 P43166 1/20 0.34

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
SCHEMBL5556337 0.88 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DMDM2
SCHEMBL5562152 0.80 FNTA (0.52) PDE4APDE4BPDE4CPDE4DMDM2
SCHEMBL5561754 0.78 HTT (0.44) PDE4APDE4BPDE4CPDE4DMDM2
SCHEMBL5562507 0.77 BRD4 (0.40) PDE4APDE4BPDE4CPDE4DMDM2
SCHEMBL5563199 0.73 MDM2 (0.41) MDM2BRD4TP53SLC6A2SLC6A3
SCHEMBL6348283 0.68 MEN1 (0.55) TP53HTTALDH1A1TSHRGAA
SCHEMBL4376572 0.67 MDM2 (0.39) MDM2TP53HTTFNTAFNTB
SCHEMBL5561611 0.66 HTT (0.46) PDE4APDE4BPDE4CPDE4DMDM2
SCHEMBL11501249 0.65 HTT (0.43) PDE4DBRD4HTTALDH1A1GAA
SCHEMBL6510724 0.63 OPRK1 (0.46) PDE4DBRD4GAA

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 7 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
CN-1094937-C Farnesyltransferase inhibiting quinazolinones JANSSEN PHARMACEUTICA NV (BE) 2002-11-27 CN 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
CN-1252800-A Quinazolinones with farnesyl transferase inhibiting activity JANSSEN PHARMACEUTICA NV (BE) 2000-05-10 CN 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