SCHEMBL8355348

SCHEMBL8355348

Cc1ccc(NC(=O)c2cc(Cl)ccc2NO)nc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.65
POLB P06746 1/20 0.62
ALDH1A1 P00352 2/20 0.60
RAB9A P51151 6/20 0.58
NPC1 O15118 4/20 0.58
KDM4E B2RXH2 3/20 0.55
LMNA P02545 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
TP53 P04637 2/20 0.54
TSHR P16473 1/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
KCNH2 Q12809 1/20 0.54
MAPT P10636 1/20 0.53
KLKB1 P03952 2/20 0.53
ALOX15 P16050 1/20 0.52
HTT P42858 1/20 0.52
GLA P06280 1/20 0.52
GAA P10253 1/20 0.52

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
SCHEMBL8353486 0.91 F10 (0.66) F10POLBALDH1A1RAB9ANPC1
SCHEMBL13313049 0.86 F10 (0.67) F10POLBKCNH2KLKB1
SCHEMBL8354573 0.85 F10 (0.64) F10ALDH1A1RAB9ANPC1KDM4E
SCHEMBL4856406 0.83 F10 (0.64) F10POLBALDH1A1RAB9ANPC1
SCHEMBL3160357 0.83 POLB (0.67) F10POLBALDH1A1RAB9ANPC1
SCHEMBL4854339 0.83 F10 (0.71) F10ALDH1A1KCNH2KLKB1
SCHEMBL4857992 0.83 F10 (0.63) F10POLBALDH1A1RAB9ANPC1
SCHEMBL5383293 0.83 F10 (0.74) F10KDM4EKCNH2KLKB1
SCHEMBL4858193 0.83 F10 (0.64) F10POLBALDH1A1RAB9ANPC1
SCHEMBL13313056 0.81 F10 (0.62) F10KCNH2KLKB1

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
WO-2003050088-A1 SUBSTITUTED HETEROCYCLIC CARBOXAMIDES WITH ANTITHROMBOTIC ACTIVITY ELI LILLY AND COMPANY (US) 2003-06-19 WO disclosed