SCHEMBL7534066

SCHEMBL7534066

O=C(O)c1cccc(C2CCCCC2)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.50
▸ ACMSD Q8TDX5 2/20 0.47
▸ KMO O15229 1/20 0.45
▸ PTGDR2 Q9Y5Y4 6/20 0.44
▸ CEL P19835 2/20 0.42
▸ SERPINE1 P05121 2/20 0.42
▸ PTGDR Q13258 3/20 0.40
▸ PTGER2 P43116 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ TAS1R3 Q7RTX0 2/20 0.39
▸ TAS1R1 Q7RTX1 2/20 0.39
▸ TAS1R2 Q8TE23 2/20 0.39
▸ FFAR2 O15552 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 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
SCHEMBL2857686 0.91 TSHR (0.55) TSHRALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL10790290 0.86 ACMSD (0.50) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL31011018 0.86 ACMSD (0.50) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL9403931 0.86 ACMSD (0.50) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL300805 0.86 ACMSD (0.50) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL10790137 0.86 ACMSD (0.50) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL11595517 0.85 ACMSD (0.49) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL10790315 0.84 ACMSD (0.49) ACMSDKMOPTGDR2ALDH1A1TAS1R3
SCHEMBL30730923 0.82 PTGDR2 (0.53) ACMSDKMOPTGDR2ALDH1A1SLC6A2
SCHEMBL50486 0.82 PTGDR2 (0.53) ACMSDKMOPTGDR2ALDH1A1SLC6A2

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
EP-1192196-A1 PROCESS FOR PRODUCING ETHYLENE/OLEFIN INTERPOLYMERS EASTMAN CHEMICAL COMPANY (US) 2002-04-03 — — EP disclosed
EP-1159315-A1 PROCESS FOR PRODUCING POLYETHYLENE EASTMAN CHEMICAL COMPANY (US) 2001-12-05 — — EP disclosed
WO-2000075204-A1 PROCESS FOR PRODUCING ETHYLENE/OLEFIN INTERPOLYMERS EASTMAN CHEMICAL COMPANY (US) 2000-12-14 — — WO disclosed
WO-2000052068-A1 PROCESS FOR PRODUCING POLYETHYLENE EASTMAN CHEMICAL COMPANY (US) 2000-09-08 — — WO disclosed
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