SCHEMBL11219615

SCHEMBL11219615

Cn1cccc1C(=O)CCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.53
▸ NR4A2 P43354 1/20 0.47
▸ RAB9A P51151 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ PKM P14618 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ KMT2A Q03164 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ FFAR1 O14842 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL7799349 0.84 NR4A2 (0.61) MAOBNR4A2RAB9ANPC1SMN1; SMN2
SCHEMBL7814459 0.83 MAOB (0.54) MAOBRAB9ANPC1SMN1; SMN2PKM
SCHEMBL11728742 0.83 MAOB (0.54) MAOBRAB9ANPC1SMN1; SMN2PKM
SCHEMBL28713425 0.81 NPC1 (0.61) MAOBRAB9ANPC1SMN1; SMN2PKM
SCHEMBL14757597 0.79 MAOB (0.57) MAOBRAB9ANPC1SMN1; SMN2PKM
SCHEMBL8392453 0.79 MAOB (0.57) MAOBRAB9ANPC1SMN1; SMN2PKM
SCHEMBL28719788 0.77 MAOB (0.53) MAOBRAB9ANPC1SMN1; SMN2PKM
SCHEMBL9264219 0.77 HRH2 (0.50) MAOBKMT2AALDH1A1FFAR1
SCHEMBL28936624 0.77 HRH2 (0.50) MAOBKMT2AALDH1A1FFAR1
SCHEMBL6834190 0.77 MAOB (0.56) MAOBRAB9ANPC1SMN1; SMN2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4342689-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1982-08-03 — — US disclosed
US-4342690-A HHYPOTENSIVE AGE TS AMERICAN CYANAMID COMPANY (US) 1982-08-03 — — US disclosed
US-4342691-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1982-08-03 — — US disclosed
US-4299769-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1981-11-10 — — US disclosed
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