SCHEMBL11158593

SCHEMBL11158593

C=CCn1c(C(=O)O)c(C(=O)c2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.52
▸ ATM Q13315 1/20 0.48
▸ ALDH1A1 P00352 6/20 0.47
▸ LMNA P02545 4/20 0.47
▸ GAA P10253 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 6/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ FABP4 P15090 1/20 0.41
▸ PKM P14618 2/20 0.41
▸ HRH1 P35367 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
SCHEMBL11163344 0.83 KDM4E (0.47) KDM4EATMALDH1A1LMNAGAA
SCHEMBL11154814 0.82 KMT2A (0.45) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL11158590 0.79 KDM4E (0.44) KDM4EATMALDH1A1LMNAGAA
SCHEMBL10964940 0.78 HSD17B10 (0.53) KDM4EATMALDH1A1LMNAGAA
SCHEMBL11164168 0.75 KDM4E (0.41) KDM4EATMALDH1A1LMNAGAA
SCHEMBL11160089 0.75 KMT2A (0.46) KDM4EALDH1A1LMNAGAAMEN1
Potassium Ion SCHEMBL11163325 0.74 KDM4E (0.44) KDM4EATMALDH1A1LMNAGAA
Benzophenone SCHEMBL28043630 0.74 CYP3A4 (0.57) KDM4EATMALDH1A1LMNAMEN1
Water SCHEMBL10964357 0.73 KMT2A (0.45) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL11163119 0.73 ALDH1A1 (0.52) KDM4EALDH1A1LMNAGAAMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4400508-A AGRICULTURE; PLANT DISEASES; ANTISEPTICS UBE INDUSTRIES, LTD. (JP) 1983-08-23 — — US claimed
EP-0052341-A1 Orotic acid derivatives and their use as agricultural chemicals UBE INDUSTRIES, LTD. (JP) 1982-05-26 — — EP claimed
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