SCHEMBL6202332

SCHEMBL6202332

CC(C)(C)OP(=O)(O)CCCc1ccc2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.40
LMNA P02545 1/20 0.40
EGLN1 Q9GZT9 1/20 0.39
POLA1 P09884 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR2 P34972 1/20 0.37
POLB P06746 2/20 0.37
HPGD P15428 2/20 0.36
CYP1A1 P04798 1/20 0.36
MAPT P10636 1/20 0.36
MAOB P27338 1/20 0.36
CYP2C9 P11712 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6198303 0.88 EGLN1 (0.43) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6198300 0.86 LMNA (0.40) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6197282 0.84 EGLN1 (0.41) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6199600 0.83 EGLN1 (0.45) NR3C1EGLN1POLA1CYP1A2CYP2C19
SCHEMBL6199591 0.82 NR3C1 (0.38) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6200817 0.82 NR3C1 (0.49) NR3C1LMNAEGLN1POLA1CYP1A2
SCHEMBL6200673 0.80 POLA1 (0.41) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6198849 0.80 EGLN1 (0.51) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6198701 0.79 POLA1 (0.41) NR3C1LMNAEGLN1POLA1SMN1; SMN2
SCHEMBL6198751 0.79 CYP1A2 (0.55) NR3C1LMNAEGLN1POLA1CYP1A2

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