SCHEMBL9842957

SCHEMBL9842957

Cc1cc(Cl)cc(-c2ccc(NC(=O)c3cnoc3)s2)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.45
KDR P35968 1/20 0.36
CSF1R P07333 2/20 0.36
SCN10A Q9Y5Y9 1/20 0.35
NFKB1 P19838 2/20 0.35
ATF1 P18846 1/20 0.35
IL2 P60568 1/20 0.35
CYP1A2 P05177 1/20 0.34
MAPK1 P28482 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9842925 0.92 CNR1 (0.39) CNR1CSF1RSCN10ANFKB1IL2
SCHEMBL9843027 0.84 CNR1 (0.52) CNR1NFKB1IL2CYP1A2MAPK1
SCHEMBL9842940 0.84 CNR1 (0.53) CNR1IL2CYP1A2MAPK1APOBEC3A
SCHEMBL9842919 0.84 CYP1A2 (0.42) CNR1NFKB1IL2CYP1A2MAPK1
SCHEMBL9843028 0.76 CNR1 (0.51) CNR1NPC1TP53MAPTRAB9A
SCHEMBL9842951 0.75 PRF1 (0.46) NFKB1CYP1A2MAPK1NPC1TP53
SCHEMBL9842991 0.75 CNR1 (0.54) CNR1IL2CYP1A2MAPK1APOBEC3A
SCHEMBL9842993 0.74 IL2 (0.48) IL2CYP1A2MAPK1APOBEC3AAPOBEC3G
SCHEMBL9842938 0.74 IL2 (0.39) CNR1KDRNFKB1IL2CYP1A2
SCHEMBL9842945 0.71 HSD17B2 (0.38) CNR1KDRNFKB1IL2CYP1A2

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-0440503-A1 4-Isoxazolecarboxamide derivatives SYNTEX (U.S.A.) INC. (US) 1991-08-07 EP disclosed