SCHEMBL10909141

SCHEMBL10909141

O=C(Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)O)c3c(O)cccc23)cc1)C(=O)Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)O)c3c(O)cccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CD40 P25942 4/20 0.52
▸ CD40LG P29965 4/20 0.52
▸ TIMP3 P35625 4/20 0.50
▸ CCR8 P51685 3/20 0.45
▸ MEN1 O00255 2/20 0.43
▸ USP2 O75604 2/20 0.43
▸ RECQL P46063 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ AURKA O14965 1/20 0.43
▸ AURKB Q96GD4 1/20 0.43
▸ FGF1 P05230 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ F11 P03951 1/20 0.41
▸ ENPP3 O14638 1/20 0.40
▸ ENTPD3 O75355 1/20 0.40

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
SCHEMBL10907664 0.95 CD40 (0.50) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL11341986 0.93 TIMP3 (0.58) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL10908486 0.92 TIMP3 (0.55) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL10909477 0.88 RECQL (0.57) TIMP3CCR8MEN1USP2RECQL
SCHEMBL11342760 0.88 TIMP3 (0.56) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL10907629 0.87 TIMP3 (0.52) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL10907711 0.87 TIMP3 (0.52) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL10908823 0.87 TIMP3 (0.52) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL11429278 0.86 AURKA (0.50) CD40CD40LGTIMP3CCR8MEN1
SCHEMBL11338955 0.84 TIMP3 (0.64) CD40CD40LGTIMP3MEN1USP2

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
US-4599204-A Oxalylamides useful as dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-08 — — US disclosed
Send feedback