SCHEMBL10964940

SCHEMBL10964940

CCCCn1c(C(=O)O)c(C(=O)c2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 5/20 0.53
▸ KDM4E B2RXH2 4/20 0.53
▸ ALDH1A1 P00352 7/20 0.53
▸ TSHR P16473 3/20 0.53
▸ HPGD P15428 3/20 0.53
▸ GAA P10253 3/20 0.50
▸ POLB P06746 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.47
▸ GLA P06280 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ KMT2A Q03164 2/20 0.44
▸ CRHBP P24387 1/20 0.44
▸ CRHR2 Q13324 1/20 0.44
▸ GPR35 Q9HC97 1/20 0.44
▸ MEN1 O00255 1/20 0.44

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
SCHEMBL11170803 0.84 KDM4E (0.48) HSD17B10KDM4EALDH1A1TSHRHPGD
SCHEMBL10961560 0.84 KDM4E (0.48) HSD17B10KDM4EALDH1A1TSHRHPGD
SCHEMBL11155201 0.82 TSHR (0.49) HSD17B10KDM4EALDH1A1TSHRHPGD
SCHEMBL11154814 0.81 KMT2A (0.45) KDM4EALDH1A1TSHRHPGDGAA
SCHEMBL10964934 0.80 ALDH1A1 (0.49) HSD17B10KDM4EALDH1A1TSHRHPGD
SCHEMBL11160089 0.79 KMT2A (0.46) HSD17B10KDM4EALDH1A1HPGDGAA
Water SCHEMBL10964357 0.78 KMT2A (0.45) HSD17B10ALDH1A1HPGDGAAMAPT
SCHEMBL11158593 0.78 KDM4E (0.52) KDM4EALDH1A1GAAPOLBMAPT
SCHEMBL11163717 0.75 MAPT (0.61) HSD17B10KDM4EALDH1A1TSHRHPGD
Lithium Ion SCHEMBL11164273 0.75 KDM4E (0.46) HSD17B10KDM4EALDH1A1TSHRHPGD

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 5 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
EP-0052341-B1 OROTIC ACID DERIVATIVES AND THEIR USE AS AGRICULTURAL CHEMICALS UBE INDUSTRIES, LTD. (JP) 1985-05-29 — — EP disclosed
US-4400508-A AGRICULTURE; PLANT DISEASES; ANTISEPTICS UBE INDUSTRIES, LTD. (JP) 1983-08-23 — — US disclosed
EP-0052341-A1 Orotic acid derivatives and their use as agricultural chemicals UBE INDUSTRIES, LTD. (JP) 1982-05-26 — — EP disclosed
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