SCHEMBL7413287

SCHEMBL7413287

CCNC1CCc2[nH]c3c(F)cc(F)cc3c2C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APOL1 O14791 3/20 0.37
HTR1B P28222 3/20 0.34
HTR1D P28221 2/20 0.34
HTR1A P08908 3/20 0.34
SLC6A4 P31645 1/20 0.34
DRD2 P14416 3/20 0.34
DRD3 P35462 2/20 0.34
DRD4 P21917 2/20 0.34
CFTR P13569 1/20 0.34
HTR1E P28566 1/20 0.33
HTR7 P34969 1/20 0.33
OPRM1 P35372 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33

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
SCHEMBL7402703 0.88 HTR1A (0.35) APOL1HTR1BHTR1DHTR1ASLC6A4
SCHEMBL7408320 0.86 HTR1A (0.46) APOL1HTR1BHTR1DHTR1ASLC6A4
SCHEMBL7410643 0.82 DRD2 (0.44) HTR1BHTR1DHTR1ADRD2DRD3
SCHEMBL7407950 0.82 TMEM97 (0.39) APOL1HTR1BHTR1DHTR1ASLC6A4
SCHEMBL7416195 0.81 RB1 (0.41) HTR1BHTR1DHTR1ASLC6A4DRD2
SCHEMBL7411050 0.81 GRIN2B (0.47) DRD2DRD3TMEM97
SCHEMBL7408004 0.81 APOL1 (0.43) APOL1HTR1BHTR1DHTR1ACFTR
SCHEMBL7404555 0.80 DRD2 (0.39) HTR1BHTR1DDRD2DRD3
SCHEMBL11344966 0.80 APOL1 (0.38) APOL1HTR1BHTR1DHTR1ASLC6A4
SCHEMBL7408795 0.79 VPS4B (0.36) HTR1BHTR1DHTR1ASLC6A4TMEM97

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