SCHEMBL9737745

SCHEMBL9737745

Fc1ccc(OCC2CCN(Cc3ccc4ccccc4c3)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.63
SLC6A4 P31645 1/20 0.63
SLC6A3 Q01959 1/20 0.63
SIGMAR1 Q99720 1/20 0.61

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
SCHEMBL7294981 0.87 SIGMAR1 (0.77) SIGMAR1
SCHEMBL466899 0.86 SIGMAR1 (0.68) SIGMAR1
SCHEMBL7294940 0.82 SIGMAR1 (0.70) SIGMAR1
SCHEMBL7330801 0.82 SLC6A2 (0.60) SLC6A2SLC6A4
SCHEMBL7295004 0.81 SIGMAR1 (0.69) SIGMAR1
SCHEMBL7335232 0.79 SIGMAR1 (0.65) SIGMAR1
Hydrochloric Acid SCHEMBL7403805 0.78 SLC6A2 (0.61) SLC6A2SLC6A4SLC6A3SIGMAR1
SCHEMBL13450806 0.76 KCNH2 (0.60)
SCHEMBL8549837 0.76 CCR3 (0.63) SIGMAR1
SCHEMBL13450914 0.75 MAOA (0.58)

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-5169855-A PIPERIDINE ETHER DERIVATIVES AS PSYCHOTROPIC DRUGS OR PLANT FUNGICIDES DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-12-08 US claimed