SCHEMBL29136423

SCHEMBL29136423

CN1Cc2cccnc2-c2cccc(N)c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD2 P14416 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
KCNH2 Q12809 1/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL29865942 1.00 CHRM2 (0.39) CHRM2HTR1ACHRM1DRD2HTR2A
SCHEMBL29866682 0.86 CHRM2 (0.37) CHRM2HTR1ACHRM1DRD2HTR2A
SCHEMBL30663579 0.82 CHRM2 (0.36) CHRM2HTR1ACHRM1DRD2HTR2A
SCHEMBL29865894 0.81 PDE10A (0.32)
SCHEMBL27107024 0.80 KCNH2 (0.37) CHRM2HTR1ACHRM1DRD2HTR2A
SCHEMBL30663590 0.80 GABRG2 (0.41) MEN1KMT2A
SCHEMBL30663578 0.78 HTR5A (0.35)
SCHEMBL29136434 0.78 HTR5A (0.35)
SCHEMBL29865871 0.77 PDE10A (0.41) CHRM1DRD2HTR2CHRH1OPRK1
SCHEMBL30663589 0.77 LMNA (0.41) CHRM2HTR1ACHRM1DRD2HTR2A

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
CN-117120440-A TYK2 inhibitor and application thereof 苏多生物科学有限公司 2023-11-24 CN disclosed