SCHEMBL11072147

SCHEMBL11072147

CCOC(=O)c1c(C)cc2nc(CO)n(-c3ccc4c(c3)OCO4)c(=O)c2c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.49
▸ HSD17B10 Q99714 5/20 0.49
▸ HPGD P15428 4/20 0.49
▸ ALOX15 P16050 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ CNR1 P21554 1/20 0.46
▸ CNR2 P34972 1/20 0.46
▸ KDM4E B2RXH2 5/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ TP53 P04637 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ TGFBR1 P36897 1/20 0.43
▸ BRD9 Q9H8M2 3/20 0.42
▸ BRD7 Q9NPI1 1/20 0.41
▸ SIRT2 Q8IXJ6 2/20 0.40
▸ SIRT1 Q96EB6 2/20 0.40
▸ MAPT P10636 4/20 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
SCHEMBL11071332 0.83 LMNA (0.47) MAPK1MEN1KMT2ACNR1CNR2
SCHEMBL11081687 0.80 CNR1 (0.59) ALDH1A1HSD17B10HPGDALOX15MAPK1
SCHEMBL11071848 0.79 CNR1 (0.57) ALDH1A1HPGDMEN1KMT2ACNR1
SCHEMBL11070514 0.78 CNR1 (0.57) ALDH1A1ALOX15MAPK1MEN1KMT2A
SCHEMBL10973972 0.78 CNR1 (0.57) ALDH1A1HPGDKMT2ACNR1CNR2
SCHEMBL11076340 0.78 CNR1 (0.45) ALDH1A1HSD17B10HPGDMEN1KMT2A
SCHEMBL11074709 0.77 CNR1 (0.56) ALDH1A1HSD17B10HPGDALOX15CNR1
SCHEMBL11079598 0.77 CNR1 (0.56) ALDH1A1CNR1CNR2SMN1; SMN2TSHR
SCHEMBL10974998 0.77 CNR1 (0.49) ALDH1A1ALOX15MAPK1MEN1KMT2A
SCHEMBL11072620 0.77 CNR1 (0.53) ALDH1A1HPGDMEN1KMT2ACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4451467-A HYPOTENSIVE AGENTS Ishikawa, Masayuki (JP) 1984-05-29 — — US disclosed
EP-0056637-A1 4(3H)-quinazolinone derivatives, process for production thereof and pharmaceutical compositions comprising said compounds Ishikawa, Masayuki (JP) 1982-07-28 — — EP disclosed
US-4276295-A VASODILATORS, HYPOTENSIVE, ANTIATHEROSCLEROTIC Ishikawa, Masayuki (JP) 1981-06-30 — — US disclosed
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