SCHEMBL6200152

SCHEMBL6200152

O=C(NCc1ccc(Cl)cc1)c1cnc2c(S(=O)(=O)NCCNc3cccc4ccccc34)cc(F)cc2c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.42
EGLN1 Q9GZT9 1/20 0.41
POLA1 P09884 1/20 0.40
CNR2 P34972 2/20 0.38
STAMBP O95630 1/20 0.38
COPS5 Q92905 1/20 0.38
TUBB P07437 1/20 0.38
LMNA P02545 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CCKBR P32239 2/20 0.37
KCNA5 P22460 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL6199451 0.88 EGLN1 (0.41) MCL1EGLN1POLA1CNR2TUBB
SCHEMBL6201217 0.88 MCL1 (0.47) MCL1EGLN1POLA1CNR2STAMBP
SCHEMBL6200333 0.86 MCL1 (0.48) MCL1EGLN1CNR2TUBBLMNA
SCHEMBL6199253 0.85 MCL1 (0.44) MCL1EGLN1POLA1CNR2TUBB
SCHEMBL6201656 0.85 MCL1 (0.44) MCL1EGLN1TUBBLMNAKMT2A
SCHEMBL6199074 0.85 MCL1 (0.44) MCL1EGLN1POLA1CNR2TUBB
SCHEMBL6201979 0.85 MCL1 (0.52) MCL1EGLN1POLA1CNR2TUBB
SCHEMBL6203244 0.85 MCL1 (0.42) MCL1EGLN1POLA1CNR2TUBB
SCHEMBL6202413 0.85 MCL1 (0.43) MCL1EGLN1POLA1CNR2TUBB
SCHEMBL6203567 0.85 MCL1 (0.43) MCL1EGLN1TUBBLMNAKMT2A

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