SCHEMBL6201656

SCHEMBL6201656

O=C(NCc1ccc(Cl)cc1)c1cnc2c(S(=O)(=O)NCCc3ccc(Cl)cc3)cc(F)cc2c1O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.44
EGLN1 Q9GZT9 2/20 0.41
KMT2A Q03164 2/20 0.41
SGMS1 Q86VZ5 1/20 0.41
LMNA P02545 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 1/20 0.40
TUBB P07437 2/20 0.39
CXCR4 P61073 1/20 0.38
NR3C1 P04150 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER2 P43116 1/20 0.38
TBXA2R P21731 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
SCHEMBL6200333 0.97 MCL1 (0.48) MCL1EGLN1KMT2ASGMS1LMNA
SCHEMBL6198666 0.95 MCL1 (0.42) MCL1EGLN1KMT2ASGMS1LMNA
SCHEMBL6199074 0.93 MCL1 (0.44) MCL1EGLN1LMNANPSR1TP53
SCHEMBL6199253 0.93 MCL1 (0.44) MCL1EGLN1KMT2ALMNAMEN1
SCHEMBL6201979 0.93 MCL1 (0.52) MCL1EGLN1KMT2ALMNAMEN1
SCHEMBL6202413 0.92 MCL1 (0.43) MCL1EGLN1LMNATP53TUBB
SCHEMBL6199190 0.92 MCL1 (0.47) MCL1EGLN1SGMS1LMNATP53
SCHEMBL6201234 0.91 MCL1 (0.42) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6203244 0.91 MCL1 (0.42) MCL1EGLN1KMT2ALMNAMEN1
SCHEMBL6203567 0.90 MCL1 (0.43) MCL1EGLN1KMT2ALMNAMAPT

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