SCHEMBL1770917

SCHEMBL1770917

CCC(=O)NCCN1CCc2ccc(OCCCc3ccccc3)cc21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.47
RECQL P46063 1/20 0.46
MTNR1A P48039 5/20 0.46
MTNR1B P49286 4/20 0.46
HPGD P15428 1/20 0.43
NQO2 P16083 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42

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
SCHEMBL1770327 0.95 MTNR1A (0.47) XIAPRECQLMTNR1AMTNR1BHPGD
SCHEMBL1770647 0.93 HPGD (0.46) XIAPMTNR1AMTNR1BHPGD
SCHEMBL27794657 0.90 XIAP (0.45) XIAPHPGDMAOAMAOB
SCHEMBL1771027 0.90 MTNR1B (0.52) XIAPMTNR1AMTNR1BMAOAMAOB
SCHEMBL1770407 0.88 XIAP (0.46) XIAPMTNR1AMTNR1B
SCHEMBL1770990 0.87 MTNR1A (0.53) XIAPMTNR1AMTNR1B
SCHEMBL1770507 0.86 MAOA (0.44) XIAPMTNR1AMTNR1BNQO2MAOA
SCHEMBL1770499 0.85 MTNR1A (0.50) XIAPMTNR1AMTNR1BMAOAMAOB
SCHEMBL1770902 0.81 MTNR1A (0.55) MTNR1AMTNR1BNQO2
SCHEMBL27794658 0.79 XIAP (0.43) XIAPMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110112148-A1 INDOLINE COMPOUNDS FERRER INTERNACIONAL S.A. 2011-05-12 US claimed
CN-101878200-A Indoline compound FERRER INT 2010-11-03 CN claimed
EP-2203423-A1 INDOLINE COMPOUNDS Ferrer Internacional, S.A. (ES) 2010-07-07 EP claimed
WO-2009053440-A1 INDOLINE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2009-04-30 WO claimed
US-20110112148-A1 INDOLINE COMPOUNDS FERRER INTERNACIONAL S.A. 2011-05-12 US disclosed
CN-101878200-A Indoline compound FERRER INT 2010-11-03 CN disclosed
EP-2203423-A1 INDOLINE COMPOUNDS Ferrer Internacional, S.A. (ES) 2010-07-07 EP disclosed
WO-2009053440-A1 INDOLINE COMPOUNDS 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-20110112148-A1 INDOLINE COMPOUNDS MTNR1A, MTNR1B, TPH2 XIAP 1156/4885RECQL 1856/4885MTNR1A 1/4885

“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.