SCHEMBL5357975

SCHEMBL5357975

COC(=O)c1ccc(-c2ccc(OCCCNc3ccc4occ(CCNC(=O)c5ccco5)c4c3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 7/20 0.61
KMT2A Q03164 3/20 0.48
MEN1 O00255 1/20 0.48
HPGD P15428 2/20 0.47
MAPK1 P28482 2/20 0.47
MTNR1A P48039 9/20 0.47
MTNR1B P49286 6/20 0.47
NPC1 O15118 2/20 0.47
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL6214782 0.92 NQO2 (0.59) NQO2KMT2AMEN1HPGDMAPK1
SCHEMBL5340606 0.90 NQO2 (0.61) NQO2KMT2AMEN1HPGDMAPK1
SCHEMBL5347071 0.85 NQO2 (0.66) NQO2MTNR1AMTNR1B
SCHEMBL5342615 0.82 NQO2 (0.77) NQO2HPGDMAPK1MTNR1AMTNR1B
SCHEMBL6219245 0.82 NQO2 (0.63) NQO2KMT2AMEN1HPGDMAPK1
SCHEMBL5350520 0.78 MTNR1A (0.76) NQO2MTNR1AMTNR1B
SCHEMBL5340697 0.78 MTNR1A (0.73) NQO2MTNR1AMTNR1B
SCHEMBL6217595 0.78 MTNR1A (0.61) NQO2MAPK1MTNR1AMTNR1B
SCHEMBL5344150 0.77 NQO2 (0.72) NQO2MTNR1AMTNR1B
SCHEMBL5340996 0.77 NQO2 (1.00) NQO2HPGDMAPK1MTNR1AMTNR1B

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-20070123529-A1 Substituted biphenyl compounds LES LABORATOIRES SERVIER (FR) 2007-05-31 US disclosed
US-7161035-B2 Substituted biphenyl derivatives, method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2007-01-09 US disclosed
US-20040014969-A1 Substituted biphenyl derivatives, method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2004-01-22 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 (2 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-20040014969-A1 Substituted biphenyl derivatives, method for preparing same and pharmaceutical compositions containing same MTNR1A, MTNR1B, MC2R NQO2 406/4885KMT2A 1293/4885MEN1 1674/4885
US-20070123529-A1 Substituted biphenyl compounds MTNR1A, MTNR1B, CNR1 NQO2 522/4885KMT2A 1674/4885MEN1 2164/4885

“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.