SCHEMBL10729347

SCHEMBL10729347

O=C(O[C@@H]1C[C@@H]2CC3(C[C@@H]2[C@H]1/C(O)=C\CCc1ccccc1)OCCO3)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 2/20 0.37
▸ HTR3E A5X5Y0 1/20 0.35
▸ HTR3B O95264 1/20 0.35
▸ HTR3A P46098 1/20 0.35
▸ HTR3D Q70Z44 1/20 0.35
▸ HTR3C Q8WXA8 1/20 0.35

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
SCHEMBL10727476 0.81 HTT (0.30) —
SCHEMBL10732034 0.80 BCHE (0.35) —
SCHEMBL10735208 0.79 BCHE (0.35) —
SCHEMBL10732529 0.79 KCNH2 (0.36) —
SCHEMBL10729081 0.79 RAB9A (0.48) —
SCHEMBL9687625 0.78 GAA (0.37) —
SCHEMBL10734682 0.76 BCHE (0.35) CHRNA7
SCHEMBL10727269 0.73 RAB9A (0.34) —
SCHEMBL10734643 0.73 RAB9A (0.34) —
SCHEMBL3827791 0.71 RAB9A (0.55) CHRNA7

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
US-4692464-A Novel prostacyclin derivatives and a process for the preparation thereof SCHERING AKTIENGESELLSCHAFT (DE) 1987-09-08 — — US disclosed
US-4359581-A Process for the production of caracyclin intermediates SCHERING AG (DE) 1982-11-16 — — US disclosed
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