SCHEMBL6202276

SCHEMBL6202276

CC(O)CCc1cc(F)cc2c(O)c(C(=O)NCc3ccc(Cl)cc3)cnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.44
EGLN1 Q9GZT9 1/20 0.42
LMNA P02545 3/20 0.41
NR3C1 P04150 1/20 0.41
PTGER4 P35408 2/20 0.41
PTGER2 P43116 1/20 0.41
TP53 P04637 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
POLA1 P09884 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL6201787 0.87 EGLN1 (0.43) CNR2EGLN1LMNANR3C1PTGER4
SCHEMBL6202581 0.87 EGLN1 (0.47) CNR2EGLN1LMNANR3C1CYP1A2
SCHEMBL6201600 0.86 EGLN1 (0.47) CNR2EGLN1LMNANR3C1PTGER4
SCHEMBL6199903 0.86 EGLN1 (0.42) CNR2EGLN1LMNANR3C1CYP1A2
SCHEMBL6201118 0.86 EGLN1 (0.44) EGLN1LMNANR3C1PTGER4PTGER2
SCHEMBL6202970 0.85 LMNA (0.43) CNR2EGLN1LMNANR3C1PTGER4
SCHEMBL6202644 0.85 EGLN1 (0.42) CNR2EGLN1LMNANR3C1PTGER4
SCHEMBL6199811 0.85 EGLN1 (0.43) CNR2EGLN1LMNANR3C1PTGER4
SCHEMBL6204166 0.85 EGLN1 (0.43) EGLN1LMNANR3C1PTGER4PTGER2
SCHEMBL6202874 0.85 LMNA (0.44) CNR2EGLN1LMNANR3C1PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP claimed