SCHEMBL2653810

SCHEMBL2653810

OCC1(c2ccc(F)cc2C2CCCCC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 2/20 0.46
▸ OPRL1 P41146 13/20 0.37
▸ F2RL1 P55085 2/20 0.37
▸ PTGDR Q13258 1/20 0.37
▸ PTPRB P23467 1/20 0.35
▸ OPRM1 P35372 2/20 0.35
▸ OPRK1 P41145 1/20 0.33

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
SCHEMBL2652996 0.77 PTGS2 (0.47) PTGDR
SCHEMBL2655331 0.77 HSP90AA1 (0.59) —
SCHEMBL2654413 0.75 PTGDR2 (0.51) PTGDR2OPRL1F2RL1PTGDRPTPRB
SCHEMBL2652954 0.75 PTGS2 (0.45) —
SCHEMBL16585059 0.74 BACE1 (0.39) —
SCHEMBL2653857 0.73 PNMT (0.37) —
SCHEMBL2568282 0.69 NUDT1 (0.51) PTGDR2OPRL1F2RL1PTGDR
SCHEMBL3634608 0.68 PTGDR2 (0.46) PTGDR2OPRL1F2RL1PTGDR
SCHEMBL11773147 0.68 KDM1A (0.52) PTGDR2OPRL1F2RL1
SCHEMBL8785689 0.67 PTGDR2 (0.48) PTGDR2OPRL1F2RL1PTGDR

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
EP-1585739-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2005-10-19 — — EP disclosed
WO-2004063179-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2004-07-29 — — WO disclosed
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