SCHEMBL11680665

SCHEMBL11680665

CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(CC)(CC)C1=C2C2CCN1CC2

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.33
▸ CNR2 P34972 3/20 0.31
▸ CNR1 P21554 2/20 0.31

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
SCHEMBL11677720 0.93 PTPN1 (0.33) KDRCNR2
SCHEMBL11678402 0.90 CNR2 (0.35) KDRCNR2CNR1
SCHEMBL11680669 0.83 CNR2 (0.40) CNR2CNR1
Hydrochloric Acid SCHEMBL11678132 0.78 — —
SCHEMBL11778876 0.76 CNR2 (0.37) KDRCNR2CNR1
SCHEMBL11677724 0.76 CNR2 (0.38) CNR2CNR1
SCHEMBL11774390 0.74 PTPN1 (0.36) KDRCNR2CNR1
SCHEMBL11678224 0.74 CNR2 (0.46) CNR2CNR1
Bromide SCHEMBL11678255 0.73 THRB (0.30) —
SCHEMBL11722742 0.73 CNR2 (0.35) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4020163-A Use of heterocyclic esters of 5H-[1]benzopyrano [3,4-b]pyridines as analgesics SHARPS ASSOCIATES (US) 1977-04-26 — — US disclosed
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