SCHEMBL4809154

SCHEMBL4809154

Cc1csc(Cl)c1-c1nc(OCc2ccc(F)c(F)c2)ncc1-c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.45
CNR2 P34972 3/20 0.42
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
HSD17B10 Q99714 1/20 0.34
APEX1 P27695 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL4808003 0.90 CNR1 (0.39) CNR1ALDH1A1MAPK1MEN1KMT2A
SCHEMBL4810311 0.83 CNR1 (0.60) CNR1CNR2ALDH1A1MEN1KMT2A
SCHEMBL4807959 0.79 CNR1 (0.64) CNR1CNR2
SCHEMBL4806724 0.75 CNR1 (0.55) CNR1CNR2
SCHEMBL4807802 0.75 CNR1 (0.55) CNR1CNR2
SCHEMBL4808602 0.74 CNR1 (0.56) CNR1CNR2
SCHEMBL4806722 0.73 CNR1 (0.52) CNR1CNR2
SCHEMBL4807874 0.72 CNR1 (0.47) CNR1ALDH1A1MAPK1MEN1KMT2A
SCHEMBL4807904 0.71 CNR1 (0.49) CNR1CNR2ALDH1A1USP2LMNA
SCHEMBL14107189 0.71 CNR1 (0.49) CNR1CNR2ALDH1A1USP2LMNA

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-7405221-B2 Substituted pyrimidines MERCK & CO., INC. (US) 2008-07-29 US disclosed
US-20050245554-A1 Substituted pyrimidines MERCK SHARP & DOHME CORP. 2005-11-03 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-20050245554-A1 Substituted pyrimidines CNR1, CNR2, GPR119 CNR1 1/4885CNR2 2/4885ALDH1A1 3049/4885

“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.