SCHEMBL136496

SCHEMBL136496

CCC(=O)NCCC1COc2ccc(OC)cc21

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 16/20 0.64
NQO2 P16083 13/20 0.64
MTNR1B P49286 13/20 0.64

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
SCHEMBL135119 0.91 MTNR1A (0.65) MTNR1ANQO2MTNR1B
SCHEMBL132847 0.88 MTNR1A (0.66) MTNR1ANQO2MTNR1B
SCHEMBL3652699 0.88 MTNR1A (0.54) MTNR1ANQO2MTNR1B
SCHEMBL9629898 0.88 MTNR1A (0.56) MTNR1ANQO2MTNR1B
SCHEMBL138000 0.87 MTNR1A (0.51) MTNR1ANQO2MTNR1B
SCHEMBL7198659 0.80 MTNR1A (0.69) MTNR1ANQO2MTNR1B
SCHEMBL7419924 0.80 HTR1A (0.54) MTNR1ANQO2MTNR1B
SCHEMBL4264345 0.79 MTNR1A (0.66) MTNR1ANQO2MTNR1B
SCHEMBL135600 0.78 MTNR1A (1.00) MTNR1ANQO2MTNR1B
SCHEMBL4687318 0.78 MTNR1A (1.00) MTNR1ANQO2MTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120059053-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN FERRER INTERNATIONAL, S.A. (ES) 2012-03-08 US claimed
EP-2205579-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN FERRER INTERNACIONAL, S.A. (ES) 2010-07-14 EP claimed
WO-2009053444-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN FERRER INTERNACIONAL, S.A. (ES) 2009-04-30 WO claimed
US-20120059053-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN FERRER INTERNATIONAL, S.A. (ES) 2012-03-08 US disclosed
EP-2205579-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN FERRER INTERNACIONAL, S.A. (ES) 2010-07-14 EP disclosed
WO-2009053444-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN FERRER INTERNACIONAL, S.A. (ES) 2009-04-30 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-20120059053-A1 COMPOUNDS OF 2,3-DIHYDRO-BENZOFURAN MTNR1A, MTNR1B, CRY2 MTNR1A 1/4885NQO2 1107/4885MTNR1B 2/4885

“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.