SCHEMBL10515854

SCHEMBL10515854

O=C(O)c1cnc(CCCc2ccccc2)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ASPH Q12797 5/20 0.50
▸ KDM8 Q8N371 5/20 0.50
▸ KDM4E B2RXH2 4/20 0.50
▸ RIOX2 Q8IUF8 3/20 0.50
▸ EGLN1 Q9GZT9 1/20 0.49
▸ KDM6B O15054 6/20 0.49
▸ KDM4C Q9H3R0 4/20 0.49
▸ KDM4D Q6B0I6 3/20 0.44
▸ POLB P06746 1/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ KDM5B Q9UGL1 3/20 0.43
▸ KDM4A O75164 2/20 0.43
▸ KDM3B Q7LBC6 2/20 0.43
▸ HIF1AN Q9NWT6 2/20 0.43
▸ KDM2A Q9Y2K7 2/20 0.43
▸ PTGER1 P34995 1/20 0.43
▸ PTGER4 P35408 1/20 0.43
▸ PTGER3 P43115 1/20 0.43
▸ PTGER2 P43116 1/20 0.43
▸ MGAM O43451 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
SCHEMBL10515745 0.96 ASPH (0.51) ASPHKDM8KDM4ERIOX2EGLN1
SCHEMBL10515374 0.82 PKM (0.49) POLBNPC1RAB9A
SCHEMBL2130083 0.77 SMN1; SMN2 (0.57) ASPHKDM8KDM4EKDM6BKDM4C
SCHEMBL29819483 0.76 TSHR (0.44) KDM4EMGAM
SCHEMBL9484774 0.74 RARB (0.41) KDM4EKDM6BKDM4C
SCHEMBL10764581 0.74 HCAR2 (0.41) ASPHKDM8KDM4EPOLBMGAM
SCHEMBL1722473 0.74 SMN1; SMN2 (0.57) ASPHKDM8KDM4ERIOX2EGLN1
SCHEMBL19857480 0.73 GABRP (0.46) KDM4EPOLBMGAMNPC1RAB9A
SCHEMBL9037560 0.73 HCAR2 (0.40) ASPHKDM8KDM4EPOLBMGAM
SCHEMBL1982703 0.71 HDAC8 (0.67) PTGER1PTGER4PTGER3PTGER2NPC1

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-0330470-A2 1,4-Dihydropyridine derivatives useful against tumour cells AJINOMOTO CO., INC. (JP) 1989-08-30 — — EP claimed
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