SCHEMBL5155380

SCHEMBL5155380

CN1CC2CN(c3cc(Cl)ncn3)CC2C1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 5/20 0.43
HTR3A P46098 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
HRH4 Q9H3N8 2/20 0.40
CYP1A2 P05177 1/20 0.38
ALOX15 P16050 1/20 0.38
CYP2C19 P33261 1/20 0.38
OGA O60502 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
APP P05067 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36

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
SCHEMBL5155386 1.00 CHRNA7 (0.43) CHRNA7HTR3ACHRNB4CHRNA3HRH4
SCHEMBL16382029 0.81 OGA (0.39) HRH4CYP1A2ALOX15CYP2C19OGA
SCHEMBL20609130 0.79 PSEN1 (0.39) CHRNA7CHRNA3OGAPSEN1PSEN2
SCHEMBL20609131 0.79 PSEN1 (0.39) CHRNA7CHRNA3OGAPSEN1PSEN2
SCHEMBL20609161 0.79 PSEN1 (0.39) CHRNA7CHRNA3OGAPSEN1PSEN2
SCHEMBL23504748 0.79 MAPK3 (0.36) CHRNA7CHRNA3OGAPSEN1PSEN2
SCHEMBL18971472 0.79 PSEN1 (0.39) CHRNA7CHRNA3OGAPSEN1PSEN2
SCHEMBL83919 0.78 CNR2 (0.42) HRH4CYP1A2ALOX15CYP2C19OGA
SCHEMBL84512 0.78 CNR2 (0.42) HRH4CYP1A2ALOX15CYP2C19OGA
SCHEMBL84511 0.78 CNR2 (0.42) HRH4CYP1A2ALOX15CYP2C19OGA

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
EP-1966162-B1 PYRIMIDINE DERIVATIVES ZIARCO PHARMA LTD (GB) 2017-03-15 EP disclosed
US-20070185075-A1 Pyrimidine derivatives PFIZER LIMITED 2007-08-09 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-20070185075-A1 Pyrimidine derivatives TYMS, DPYD, TYMP CHRNA7 4295/4885HTR3A 1577/4885CHRNB4 4611/4885

“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.