SCHEMBL5318736

SCHEMBL5318736

Oc1ccc2c(c1)CCC2N1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.51
▸ DRD1 P21728 1/20 0.51
▸ DRD4 P21917 1/20 0.51
▸ DRD5 P21918 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ ESR1 P03372 8/20 0.46
▸ ESR2 Q92731 8/20 0.46
▸ CHRNA7 P36544 1/20 0.45
▸ SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL5327803 0.98 DRD2 (0.52) DRD2DRD1DRD4DRD5DRD3
SCHEMBL29795153 0.89 DRD2 (0.61) DRD2DRD1DRD4DRD5DRD3
SCHEMBL5327927 0.84 DRD2 (0.49) DRD2DRD1DRD4DRD5DRD3
SCHEMBL30364101 0.79 CHRNA7 (0.46) CHRNA7
SCHEMBL3866433 0.79 CHRNA7 (0.46) CHRNA7
SCHEMBL3863017 0.79 CHRNA7 (0.46) CHRNA7
SCHEMBL26180067 0.77 DRD2 (0.45) DRD2DRD1DRD4DRD5DRD3
SCHEMBL21142551 0.76 CHRNA7 (0.74) CHRNA7SIGMAR1
SCHEMBL3402404 0.76 CHRNA7 (0.74) CHRNA7SIGMAR1
SCHEMBL24570645 0.75 CHRNA7 (0.40) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622923-A4 MOLECULAR DETECTION SYSTEMS UTILIZING REITERATIVE OLIGONUCLEOTIDE SYNTHESIS RIBOMED BIOTECHNOLOGIES INC (US) 2007-11-28 — — EP disclosed
WO-2007099423-A1 1-PYRROLIDINE INDANE DERIVATIVES AS HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2007-09-07 — — WO disclosed
WO-2007099423-A1 1-PYRROLIDINE INDANE DERIVATIVES AS HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2007-09-07 — — WO disclosed
EP-1622923-A2 MOLECULAR DETECTION SYSTEMS UTILIZING REITERATIVE OLIGONUCLEOTIDE SYNTHESIS Ribomed Biotechnologies, Inc. (US) 2006-02-08 — — EP disclosed
WO-2004096997-A2 MOLECULAR DETECTION SYSTEMS UTILIZING REITERATIVE OLIGONUCLEOTIDE SYNTHESIS RIBOMED BIOTECHNOLOGIES, INC. (US) 2004-11-11 — — WO disclosed
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