SCHEMBL7411920

SCHEMBL7411920

CNC1CCc2[nH]c3c(Cl)cc(Cl)cc3c2C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.46
HTR1B P28222 2/20 0.46
HTR1D P28221 1/20 0.46
CGAS Q8N884 1/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
HTR1E P28566 1/20 0.41
HTR7 P34969 1/20 0.41
OPRM1 P35372 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41
AR P10275 5/20 0.38
CHEK1 O14757 1/20 0.36
ABL1 P00519 1/20 0.36
MET P08581 1/20 0.36
PIM1 P11309 1/20 0.36
FGFR1 P11362 1/20 0.36
LTK P29376 1/20 0.36
MAPK8 P45983 1/20 0.36
CDK8 P49336 1/20 0.36
GSK3B P49841 1/20 0.36

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
SCHEMBL7406537 0.86 CGAS (0.42) HTR1AHTR1BHTR1DCGASDRD2
SCHEMBL7415569 0.84 CGAS (0.45) HTR1AHTR1BHTR1DCGASAR
SCHEMBL7412968 0.79 AR (0.45) HTR1BCGASARCHEK1ABL1
SCHEMBL7411747 0.78 CGAS (0.41) HTR1AHTR1BHTR1DCGASHTR7
SCHEMBL28834665 0.78 HTR1B (0.65) HTR1AHTR1BHTR1DDRD2DRD4
SCHEMBL7408320 0.76 HTR1A (0.46) HTR1AHTR1BHTR1DDRD2DRD4
SCHEMBL7410485 0.74 CGAS (0.42) HTR1AHTR1DCGASHTR7AR
SCHEMBL7020838 0.71 AR (0.51) CGASARCHEK1ABL1MET
SCHEMBL14623596 0.69 HTR1B (0.41) HTR1AHTR1BHTR1DCGASDRD2
SCHEMBL4803895 0.69 NR2E1 (0.61) HTR1AHTR1BHTR1DDRD2DRD4

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