SCHEMBL19862554

SCHEMBL19862554

CC(C)NC1CCCc2cc(Cl)ccc21

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.44
TAS1R1 Q7RTX1 3/20 0.44
TAS1R2 Q8TE23 3/20 0.44
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PFKFB3 Q16875 1/20 0.40
LMNA P02545 1/20 0.39
SRD5A1 P18405 3/20 0.39
SRD5A2 P31213 2/20 0.39
SCN3A Q9NY46 1/20 0.39
FADS1 O60427 1/20 0.38

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
SCHEMBL19865656 0.84 PDPK1 (0.46) TAS1R3TAS1R1TAS1R2HTR2AHTR2C
SCHEMBL16252290 0.79 TAS1R3 (0.52) TAS1R3TAS1R1TAS1R2SCN3A
SCHEMBL18435285 0.79 TAS1R3 (0.52) TAS1R3TAS1R1TAS1R2SCN3A
SCHEMBL19865632 0.78 LRRK2 (0.47) LMNA
SCHEMBL25516793 0.78 SRD5A1 (0.43) TAS1R3TAS1R1TAS1R2HTR2AHTR2C
SCHEMBL10159937 0.77 PDPK1 (0.53) TAS1R3TAS1R1TAS1R2LMNA
SCHEMBL13164295 0.77 PDPK1 (0.53) TAS1R3TAS1R1TAS1R2LMNA
SCHEMBL12130659 0.77 PDPK1 (0.53) TAS1R3TAS1R1TAS1R2LMNA
SCHEMBL15577013 0.75 HTR2C (0.58) TAS1R3TAS1R1TAS1R2HTR2AHTR2C
SCHEMBL18468830 0.75 HTR2C (0.58) TAS1R3TAS1R1TAS1R2HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 US disclosed
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE PDE3A, PDE2A, PDE5A TAS1R3 4061/4885TAS1R1 3875/4885TAS1R2 4380/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.