SCHEMBL7408792

SCHEMBL7408792

CC(C)c1ccc(CN(C)C2CCc3[nH]c4c(F)cc(F)cc4c3C2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.38
HTR1F P30939 1/20 0.36
HTR1D P28221 3/20 0.34
HTR1B P28222 3/20 0.34
PDE2A O00408 1/20 0.34
VPS4B O75351 1/20 0.33
VCP P55072 1/20 0.33
DPP4 P27487 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
APOL1 O14791 2/20 0.31
PARP1 P09874 1/20 0.31
HTR1A P08908 2/20 0.31
CFTR P13569 1/20 0.31

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
SCHEMBL7407947 0.91 HTR1F (0.41) HTR6HTR1FHTR1DHTR1BVPS4B
SCHEMBL7416193 0.89 HTR1F (0.36) HTR6HTR1FHTR1DHTR1BDPP4
SCHEMBL7411041 0.88 GRIN2B (0.41) HTR6HTR1FHTR1DHTR1B
Iodomethane SCHEMBL7409589 0.86 GRIN2B (0.40) HTR6HTR1FHTR1DHTR1B
SCHEMBL7404550 0.84 SPHK1 (0.36) HTR1FHTR1DHTR1BHTR1A
SCHEMBL7409892 0.82 HTR1D (0.44) HTR1DHTR1B
SCHEMBL7414227 0.81 SLC6A2 (0.38) HTR6HTR1FDPP4DPP9DPP7
SCHEMBL7408841 0.81 HTR1F (0.45) HTR6HTR1FHTR1DHTR1BVPS4B
SCHEMBL7407176 0.81 HTR1F (0.39) HTR6HTR1FDPP4DPP9DPP7
Hydrochloric Acid SCHEMBL7406784 0.80 HTR1F (0.39) HTR6HTR1FDPP4DPP9DPP7

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