SCHEMBL9804167

SCHEMBL9804167

Clc1ccc(N=C(c2ccccc2)N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 2/20 0.41
HTR3B O95264 2/20 0.41
HTR3A P46098 2/20 0.41
HTR3D Q70Z44 2/20 0.41
HTR3C Q8WXA8 2/20 0.41
SLC22A2 O15244 1/20 0.41
SLC22A1 O15245 1/20 0.41
SLC22A3 O75751 1/20 0.41
PLAU P00749 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 2/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 5/20 0.40
KMT2A Q03164 5/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
CES2 O00748 1/20 0.40

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
SCHEMBL9804122 0.97 HTR3E (0.41) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9804178 0.93 KMT2A (0.40) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9804215 0.87 KMT2A (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL14975485 0.87 KMT2A (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9804129 0.81 CYP2D6 (0.45) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9804173 0.77 KMT2A (0.42) TDP1GAAHPGDLMNAALDH1A1
SCHEMBL9804159 0.76 CYP2D6 (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9804105 0.76 HTR3E (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL6547521 0.74 ESR1 (0.68) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8429357 0.73 KMT2A (0.48) HTR3EHTR3BHTR3AHTR3DHTR3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153616-B1 HEAT-SENSITIVE RECORDING MATERIALS KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-04-03 EP disclosed
US-4652512-A DIAZONIUM COMPOUND KANZAKI PAPER MANUFACTURING COMPANY, LIMITED (JP) 1987-03-24 US disclosed
EP-0153616-A2 Heat-sensitive recording materials KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1985-09-04 EP disclosed