SCHEMBL6202650

SCHEMBL6202650

O=C(NCc1ccc(Cl)cc1)c1cnc2c(S(=O)(=O)NCCc3c[nH]cn3)cc(F)cc2c1O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.39
EGLN1 Q9GZT9 1/20 0.36
LMNA P02545 1/20 0.36
TUBB P07437 2/20 0.35
CXCR4 P61073 1/20 0.34
NR3C1 P04150 1/20 0.34
PTGER4 P35408 1/20 0.34
PTGER2 P43116 1/20 0.34
GSK3B P49841 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
CCKBR P32239 1/20 0.34
CNR2 P34972 2/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLA1 P09884 1/20 0.33

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
SCHEMBL6201656 0.90 MCL1 (0.44) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6196942 0.88 TUBB (0.39) MCL1EGLN1LMNATUBBGSK3B
SCHEMBL6203567 0.87 MCL1 (0.43) MCL1EGLN1LMNATUBBKMT2A
SCHEMBL6200333 0.86 MCL1 (0.48) MCL1EGLN1LMNATUBBMEN1
SCHEMBL6198666 0.86 MCL1 (0.42) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6199253 0.86 MCL1 (0.44) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6199074 0.86 MCL1 (0.44) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6201979 0.86 MCL1 (0.52) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6202413 0.85 MCL1 (0.43) MCL1EGLN1LMNATUBBCXCR4
SCHEMBL6198294 0.84 MGAM (0.53) MEN1KMT2AMAPTALDH1A1

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