SCHEMBL23680784

SCHEMBL23680784

CC(C)N(C=N)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49
HTR3A P46098 1/20 0.49
HTR3D Q70Z44 1/20 0.49
HTR3C Q8WXA8 1/20 0.49
MAPT P10636 1/20 0.41
TAAR1 Q96RJ0 4/20 0.40
RORC P51449 5/20 0.39
PNMT P11086 1/20 0.37
TSHR P16473 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL10694837 0.75 HTR3E (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL20893254 0.73 MAPT (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL14404368 0.72 HTR3E (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL22319800 0.69 HTR3E (0.46) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2767320 0.68 HTR3E (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL60096 0.68 HTR3E (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL29636353 0.68 HTR3E (0.57) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL11521979 0.67 MAPT (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL9336109 0.67 HTR3E (0.51) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8025254 0.67 ALDH1A1 (0.44) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021151014-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING MYOFORTE THERAPEUTICS, INC. (US) 2021-07-29 WO disclosed