SCHEMBL9319138

SCHEMBL9319138

CCOC(=O)c1cnc(C(=O)OC)cc1C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.48
▸ HPGD P15428 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ DPP4 P27487 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ GABRP O00591 4/20 0.45
▸ GABRD O14764 4/20 0.45
▸ GABRA1 P14867 4/20 0.45
▸ GABRB1 P18505 4/20 0.45
▸ GABRG2 P18507 4/20 0.45
▸ GABRB3 P28472 4/20 0.45
▸ GABRA5 P31644 4/20 0.45
▸ GABRA3 P34903 4/20 0.45
▸ GABRA2 P47869 4/20 0.45
▸ GABRB2 P47870 4/20 0.45
▸ GABRA4 P48169 4/20 0.45
▸ GABRE P78334 4/20 0.45
▸ GABRA6 Q16445 4/20 0.45

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
SCHEMBL9319716 1.00 KDM4E (0.48) KDM4EHPGDPKMHSD17B10DPP4
SCHEMBL10465494 0.90 GABRA1 (0.52) KDM4EHPGDPKMHSD17B10DPP4
SCHEMBL10467645 0.88 MAPK1 (0.52) KDM4EHPGDPKMHSD17B10GABRP
SCHEMBL9318633 0.79 KDM4E (0.49) KDM4EHPGDNPC1RAB9AGABRP
SCHEMBL9318646 0.78 MAPK1 (0.49) KDM4EHPGDPKMHSD17B10GABRP
SCHEMBL9400503 0.76 ALDH1A1 (0.50) KDM4EHSD17B10NPC1RAB9AGABRP
SCHEMBL25738012 0.76 KDM4E (0.41) KDM4EHPGDPKMHSD17B10DPP4
SCHEMBL3516119 0.76 BAZ2B (0.49) KDM4EHPGDDPP4NPC1RAB9A
SCHEMBL26115003 0.74 KDM4E (0.45) KDM4EHPGDALDH1A1MAPTTSHR
SCHEMBL3230064 0.73 CFTR (0.53) KDM4EHPGDPKMHSD17B10GABRP

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-0281943-B1 Substituted pyridine-2,4-carboxylic acid derivatives, process for their preparation, their use as well as medicaments based on these compounds HOECHST AG (DE) 1994-01-12 — — EP claimed
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