SCHEMBL4583034

SCHEMBL4583034

COc1ccc2cccc(C(CO)CNC(=O)CCCCl)c2c1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 18/20 0.76
MTNR1B P49286 13/20 0.76
HTR2C P28335 6/20 0.76
NQO2 P16083 1/20 0.43

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
SCHEMBL3831576 0.86 MTNR1A (1.00) MTNR1AMTNR1BHTR2C
SCHEMBL3831492 0.86 MTNR1A (1.00) MTNR1AMTNR1BHTR2C
SCHEMBL3834460 0.86 MTNR1A (1.00) MTNR1AMTNR1BHTR2C
SCHEMBL4581414 0.85 MTNR1A (1.00) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL30706222 0.85 MTNR1A (1.00) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL4581114 0.85 MTNR1A (1.00) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL3328757 0.85 MTNR1A (1.00) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL3328976 0.84 MTNR1A (1.00) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL4583206 0.83 MTNR1A (0.78) MTNR1AMTNR1BHTR2CNQO2
SCHEMBL4593220 0.81 MTNR1A (0.78) MTNR1AMTNR1BHTR2CNQO2

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-1900723-A1 New naphthalene derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2008-03-19 EP disclosed
US-20080004348-A1 Naphthalene compounds LES LABORATOIRES SERVIER (FR) 2008-01-03 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-20080004348-A1 Naphthalene compounds MTNR1A, MTNR1B, CNR1 MTNR1A 1/4885MTNR1B 2/4885HTR2C 53/4885

“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.