SCHEMBL7280876

SCHEMBL7280876

CCOC(=O)C(=O)CCC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
METAP2 P50579 1/20 0.44
HPGD P15428 2/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 1/20 0.39
FAAH O00519 2/20 0.39

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
SCHEMBL7362812 0.98 METAP2 (0.42) HSD11B1METAP2HPGDMEN1KMT2A
SCHEMBL30877175 0.91 FAAH (0.42) METAP2HPGDMAPTALDH1A1TDP1
SCHEMBL7641554 0.90 CYP1A2 (0.46) METAP2NPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL25062701 0.82 METAP2 (0.41) HSD11B1METAP2HPGDMEN1KMT2A
SCHEMBL1172293 0.81 MEN1 (0.54) HSD11B1HPGDMEN1KMT2AMAPT
SCHEMBL31323929 0.81 MEN1 (0.54) HSD11B1HPGDMEN1KMT2AMAPT
SCHEMBL9744436 0.81 MEN1 (0.54) HSD11B1HPGDMEN1KMT2AMAPT
SCHEMBL4737887 0.81 ALDH1A1 (0.41) METAP2HPGDKMT2AMAPTATM
SCHEMBL18311726 0.81 MEN1 (0.54) HSD11B1HPGDMEN1KMT2AMAPT
SCHEMBL16761652 0.80 NAAA (0.36) METAP2MEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103298468-A Ring-fused heterocyclic derivative KYOWA HAKKO KIRIN CO LTD 2013-09-11 CN disclosed
US-4897379-A N-[N.sup.α -(1(S)-carboxy-3-cyclohexylpropyl)-L-lysyl]-N-cyclopentylglycine as antihypertensives ASAHI BREWERIES LTD. (JP) 1990-01-30 US disclosed
EP-0284510-A2 N-[N alpha-(1(S)-carboxy-3-cyclohexyl-propyl)-1-lysyl] N-cyclopentylglycine as antihypertensives Asahi Breweries, Ltd. (JP) 1988-09-28 EP disclosed
US-4591458-A ENZYME INHIBITORS; HYPOTENSIVE AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-05-27 US disclosed
US-4564612-A ANGIOTENSION CONVERTING ENZYME INHIBITORS, HYPOTENSIVE AGENTS, BENZOTHIAZEPINES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-01-14 US disclosed
US-4548932-A ANGIOTENSIN INHIBITOR, HYPOTENSIVE AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-10-22 US disclosed
EP-0135349-A1 Condensed seven-membered ring compounds and their production and use Takeda Chemical Industries, Ltd. (JP) 1985-03-27 EP disclosed
EP-0125056-A2 Condensed, seven-membered ring compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1984-11-14 EP disclosed