SCHEMBL7410347

SCHEMBL7410347

CN(C)C1CCc2[nH]c3ccc(S(C)(=O)=O)cc3c2C1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 1/20 0.54
HTR6 P50406 4/20 0.51
MAPT P10636 4/20 0.45
LMNA P02545 3/20 0.45
KMT2A Q03164 3/20 0.44
TP53 P04637 2/20 0.43
CFTR P13569 1/20 0.43
MEN1 O00255 2/20 0.42
HTR1B P28222 6/20 0.42
HTR1D P28221 5/20 0.42
THRB P10828 1/20 0.41
HTR1A P08908 1/20 0.41

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
SCHEMBL7651487 0.84 HTR1F (0.78) HTR1FMAPTLMNAKMT2ATP53
SCHEMBL7658032 0.83 HTR1F (0.53) HTR1FHTR6MAPTLMNAKMT2A
Hydrochloric Acid SCHEMBL7659662 0.82 HTR1F (0.52) HTR1FHTR6MAPTLMNAKMT2A
SCHEMBL7403681 0.81 HTR1F (0.56) HTR1FLMNAKMT2AHTR1BHTR1D
SCHEMBL7410109 0.80 HTR1F (0.55) HTR1FHTR6KMT2AMEN1HTR1B
SCHEMBL7417626 0.80 HTR1F (0.55) HTR1FHTR6LMNAKMT2ATP53
SCHEMBL6964061 0.80 HTR1F (0.55) HTR1FHTR6MAPTKMT2AHTR1B
SCHEMBL7407128 0.80 HTR1F (0.67) HTR1FHTR6KMT2AHTR1BHTR1D
SCHEMBL6963427 0.80 HTR1F (0.58) HTR1FKMT2AMEN1HTR1BHTR1D
SCHEMBL7412227 0.80 MAPT (0.60) HTR1FMAPTLMNAKMT2AMEN1

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