SCHEMBL7414253

SCHEMBL7414253

CN(C)C1CCc2[nH]c3cc(Cl)cc(Cl)c3c2C1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.42
HTR7 P34969 7/20 0.42
HTR1F P30939 1/20 0.40
CHRM3 P20309 2/20 0.37
HTR1D P28221 5/20 0.36
HTR1B P28222 4/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
HTR6 P50406 2/20 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
SCHEMBL7409139 0.88 HTR1F (0.40) HTR1AHTR7HTR1FCHRM3HTR1D
SCHEMBL7402841 0.88 HTR1F (0.42) HTR1AHTR7HTR1FCHRM3HTR1D
SCHEMBL7405543 0.84 HTR1A (0.47) HTR1AHTR7HTR1FCHRM3HTR1D
SCHEMBL7411747 0.78 CGAS (0.41) HTR1AHTR7HTR1FHTR1DHTR1B
SCHEMBL7413544 0.77 HTR1F (0.41) HTR1FCHRM3HTR1DHTR1BCHRM2
SCHEMBL7417626 0.76 HTR1F (0.55) HTR1FHTR1DHTR1BHTR6
SCHEMBL7413980 0.75 DRD2 (0.36) HTR1AHTR7HTR1DHTR1B
SCHEMBL7410893 0.75 HTR1A (0.40) HTR1AHTR7HTR1FCHRM3HTR1D
SCHEMBL7410925 0.74 CHRM3 (0.43) HTR1AHTR7HTR1FCHRM3HTR1D
SCHEMBL7415593 0.74 MTNR1A (0.42) HTR1AHTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4257952-A PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES STERLING DRUG INC. (US) 1981-03-24 US disclosed
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US disclosed
US-4062864-A ANALGESIC, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1977-12-13 US disclosed
US-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed