SCHEMBL7434232

SCHEMBL7434232

CC(C)c1[nH]c(=O)[nH]c1C(=O)c1cccs1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ LMNA P02545 5/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ PTGS1 P23219 2/20 0.43
▸ PTGS2 P35354 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ RAB9A P51151 5/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ HPGDS O60760 1/20 0.42
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ DAO P14920 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
SCHEMBL7432480 0.84 MEN1 (0.39) HPGDALDH1A1LMNACYP2C9PTGS1
SCHEMBL10877089 0.80 MEN1 (0.56) HPGDALDH1A1LMNACYP2C9PTGS1
SCHEMBL7436437 0.80 HPGD (0.44) HPGDALDH1A1LMNACYP2C9PTGS1
SCHEMBL10876269 0.73 HPGDS (0.42) HPGDALDH1A1LMNAKDM4ERAB9A
SCHEMBL10879980 0.73 HPGD (0.44) HPGDALDH1A1LMNACYP2C9RAB9A
SCHEMBL10884329 0.71 HPGD (0.40) HPGDALDH1A1LMNACYP2C9KDM4E
SCHEMBL182010 0.69 CES2 (0.71) HPGDALDH1A1LMNACYP2C9PTGS1
SCHEMBL9787284 0.68 HPGD (0.43) HPGDALDH1A1LMNACYP2C9PTGS1
SCHEMBL10136508 0.67 LMNA (0.62) HPGDALDH1A1LMNACYP2C9PTGS1
SCHEMBL2739306 0.67 HPGD (0.74) HPGDALDH1A1LMNACYP2C9PTGS1

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-4405628-A 4-Pyridylimidazolones and method of use MERRELL DOW PHARMACEUTICALS INC. (US) 1983-09-20 — — US disclosed
EP-0059948-A1 Novel aroylimidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-09-15 — — EP disclosed
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