SCHEMBL8886408

SCHEMBL8886408

CCCN(CCC)C1CCc2cc(F)c3[nH]ccc3c2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 17/20 1.00
HTR1B P28222 13/20 1.00

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
SCHEMBL8315482 0.78 HTR1D (1.00) HTR1DHTR1B
SCHEMBL7445674 0.78 HTR1D (0.64) HTR1DHTR1B
SCHEMBL10985541 0.76 HTR1D (0.66) HTR1DHTR1B
SCHEMBL8887262 0.76 HTR1D (1.00) HTR1DHTR1B
SCHEMBL8886184 0.75 HTR1D (1.00) HTR1DHTR1B
SCHEMBL7437054 0.74 HTR1D (0.60) HTR1DHTR1B
SCHEMBL9186743 0.72 DRD2 (0.80) HTR1DHTR1B
SCHEMBL7445563 0.72 HTR1D (0.56) HTR1DHTR1B
SCHEMBL7434651 0.72 HTR1D (0.83) HTR1DHTR1B
SCHEMBL8316283 0.71 HTR1D (1.00) HTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650427-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1997-07-22 US disclosed
US-5461061-A Antidepressants WIKSTROM HAKAN V (NL) 1995-10-24 US disclosed
US-5288748-A Antidepressants THE UPJOHN COMPANY (US) 1994-02-22 US disclosed