SCHEMBL4868682

SCHEMBL4868682

O=C(Nc1ccc(OCc2ccccc2)cc1)N1CCCCc2ccc(Cl)cc21

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.56
FAAH O00519 1/20 0.53
MAPT P10636 2/20 0.52
LMNA P02545 4/20 0.52
THRB P10828 2/20 0.49
POLB P06746 1/20 0.49
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
LTA4H P09960 1/20 0.48

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
SCHEMBL4865966 0.92 TP53 (0.57) TP53FAAHMAPTLMNATHRB
SCHEMBL4871248 0.88 MAPT (0.61) TP53MAPTLMNATHRBPOLB
SCHEMBL4868920 0.88 TP53 (0.53) TP53FAAHMAPTLMNATHRB
SCHEMBL4862251 0.88 TP53 (0.67) TP53MAPTLMNATHRBPOLB
SCHEMBL4863830 0.87 TP53 (0.66) TP53MAPTLMNATHRBPOLB
SCHEMBL4869342 0.86 PDK1 (0.60) TP53FAAHMAPTLMNATHRB
SCHEMBL4554972 0.84 MAPT (0.69) TP53MAPTLMNATHRBPOLB
SCHEMBL4870653 0.83 PDK1 (0.61) TP53FAAHMAPTLMNATHRB
SCHEMBL4860848 0.82 MAPT (0.61) TP53MAPTLMNATHRBPOLB
SCHEMBL4863029 0.82 TP53 (0.53) TP53FAAHMAPTLMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US disclosed
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 US disclosed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 EP 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-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient CNR1, CNR2, NPSR1 TP53 4170/4885FAAH 689/4885MAPT 3398/4885

“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.