SCHEMBL1122731

SCHEMBL1122731

COC(=O)c1ccc(OCc2cccc(OCc3ccccc3)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.64
▸ MEN1 O00255 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ RAB9A P51151 4/20 0.64
▸ MAPT P10636 3/20 0.64
▸ MRGPRX4 Q96LA9 3/20 0.62
▸ FFAR1 O14842 1/20 0.61
▸ NPC1 O15118 2/20 0.60
▸ MAOB P27338 2/20 0.60
▸ NR4A2 P43354 2/20 0.59
▸ NR4A1 P22736 1/20 0.59
▸ NR4A3 Q92570 1/20 0.59
▸ LMNA P02545 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ PTPRC P08575 1/20 0.57
▸ PTPN1 P18031 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ TP53 P04637 1/20 0.57
▸ PKM P14618 1/20 0.57
▸ NFKB1 P19838 1/20 0.57

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
SCHEMBL978502 0.91 RAB9A (0.71) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL3646136 0.90 RAB9A (0.65) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL1122805 0.90 MRGPRX4 (0.71) MEN1KMT2AMRGPRX4FFAR1MAOB
SCHEMBL1122722 0.89 MAOB (0.68) SMN1; SMN2MEN1KMT2ARAB9AMRGPRX4
SCHEMBL6162284 0.88 SMN1; SMN2 (0.79) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL13462818 0.87 SMN1; SMN2 (0.62) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL30412034 0.87 MAOB (0.73) MEN1KMT2AMRGPRX4MAOBNR4A2
SCHEMBL976424 0.87 MAOB (0.73) MEN1KMT2AMRGPRX4MAOBNR4A2
SCHEMBL9343582 0.87 SMN1; SMN2 (0.65) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL6341485 0.87 SMN1; SMN2 (0.65) SMN1; SMN2MEN1KMT2ARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 — — EP disclosed
CN-1835914-A New benzamides as PPAR[upsilon] modulators S A L V A T LAB SA (ES) 2006-09-20 — — CN disclosed
US-20060160894-A1 Benzamides as ppar modulators LABORATORIOS S.A.L.V.A.T.,S.A. (ES) 2006-07-20 — — US disclosed
EP-1644321-A2 NEW BENZAMIDES AS PPATY MODULATORS LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2006-04-12 — — EP disclosed
WO-2004110983-A2 NEW BENZAMIDES AS PPARϒ MODULATORS LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2004-12-23 — — 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-20060160894-A1 Benzamides as ppar modulators PPARD, PPARA, PPARG SMN1; SMN2 3984/4885MEN1 4877/4885KMT2A 1515/4885

“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.

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