SCHEMBL29329473

SCHEMBL29329473

Clc1c2c(nc3ccnn13)CC1(CCCCC1)CC2

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.38
HTR2B P41595 6/20 0.38
HTR2A P28223 5/20 0.38
PDE10A Q9Y233 1/20 0.35

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
SCHEMBL4955735 0.79 HTR2C (0.47) HTR2CHTR2BHTR2APDE10A
SCHEMBL4955234 0.77 HTR2C (0.46) HTR2CHTR2BHTR2APDE10A
SCHEMBL4956864 0.77 HTR2C (0.46) HTR2CHTR2BHTR2APDE10A
SCHEMBL29329834 0.76
SCHEMBL29329459 0.76 PDE10A (0.36) HTR2CHTR2BHTR2APDE10A
SCHEMBL29329456 0.74 PDE10A (0.37) HTR2CHTR2BHTR2APDE10A
SCHEMBL29329570 0.71 PDE10A (0.37) HTR2CHTR2BHTR2APDE10A
SCHEMBL29329467 0.71 PDE10A (0.37) HTR2CHTR2BHTR2APDE10A
SCHEMBL29329754 0.71 PDE10A (0.39) HTR2CHTR2BHTR2APDE10A
SCHEMBL9947789 0.70 HTR2C (0.65) HTR2CHTR2BHTR2APDE10A

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-2024151112-A1 PYRAZOLOPYRIMIDINE DERIVATIVE AS CYCLIN-DEPENDENT KINASE 9 INHIBITOR 주식회사 티움바이오 2024-07-18 WO disclosed