SCHEMBL10690922

SCHEMBL10690922

COc1cccc(/C=C/c2nc3c(C(=O)O)cccc3[nH]2)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.49
▸ NFE2L2 Q16236 3/20 0.48
▸ PARP1 P09874 2/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ AGTR1 P30556 1/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ MAPT P10636 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ CYP1A1 P04798 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ TRPM8 Q7Z2W7 1/20 0.44
▸ ABL1 P00519 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ LYN P07948 1/20 0.43
▸ SRC P12931 1/20 0.43

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
SCHEMBL10687218 0.92 DHODH (0.48) DHODHPARP1KMT2ANPC1RAB9A
SCHEMBL10688446 0.91 DHODH (0.54) DHODHNFE2L2PARP1KMT2ANPC1
Phosphoric Acid SCHEMBL10686961 0.89 DHODH (0.45) DHODHPARP1KMT2ANPC1RAB9A
SCHEMBL10683972 0.88 PARP1 (0.49) DHODHNFE2L2PARP1KMT2ANPC1
SCHEMBL10684918 0.84 KMT2A (0.54) DHODHPARP1KMT2AMEN1AGTR1
SCHEMBL10687494 0.83 DHODH (0.50) DHODHNFE2L2PARP1KMT2AMEN1
SCHEMBL10689508 0.83 DHODH (0.50) DHODHPARP1KMT2ANPC1RAB9A
SCHEMBL10690932 0.82 ABL1 (0.51) NFE2L2KMT2ANPC1RAB9AMEN1
SCHEMBL10690859 0.80 DHODH (0.52) DHODHPARP1KMT2ANPC1RAB9A
SCHEMBL10687590 0.80 DHODH (0.52) DHODHPARP1KMT2ANPC1RAB9A

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-4769384-A ANTIULCER AGENTS NIPPON SHINYAKU CO. LTD. (JP) 1988-09-06 — — US disclosed
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