SCHEMBL4809795

SCHEMBL4809795

Oc1ncc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 14/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
CNR2 P34972 6/20 0.48
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL4802881 0.82 KMT2A (0.61) CNR1MEN1KMT2ACNR2MAPT
SCHEMBL6025511 0.82 MEN1 (0.62) CNR1MEN1KMT2ACNR2
SCHEMBL4808041 0.81 CNR1 (0.54) CNR1CNR2
SCHEMBL4807383 0.80 CNR1 (0.53) CNR1CNR2
SCHEMBL6025473 0.80 CNR1 (0.51) CNR1CNR2
SCHEMBL4806129 0.78 KDM4E (0.62) CNR1MEN1KMT2ACNR2MAPT
SCHEMBL4804885 0.78 CNR1 (0.49) CNR1CNR2
SCHEMBL4806164 0.76 CNR1 (0.47) CNR1CNR2
SCHEMBL4810403 0.76 CNR1 (0.43) CNR1MEN1KMT2ACNR2MAPT
SCHEMBL4806021 0.75 CNR1 (0.54) CNR1CNR2

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 4 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
EP-1546115-A2 SUBSTITUTED PYRIMIDINES Merck & Co., Inc. (US) 2005-06-29 EP disclosed
WO-2004029204-A2 SUBSTITUTED PYRIMIDINES MERCK & CO., INC. (US) 2004-04-08 WO 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 1/4885MEN1 627/4885KMT2A 3592/4885

“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.