SCHEMBL6776046

SCHEMBL6776046

Cc1oc(-c2ccc(N(C)C)cc2)nc1Cc1ccc(/C=C/CSCC(=O)O)o1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
HSD17B10 Q99714 2/20 0.37
SMN1; SMN2 Q16637 6/20 0.36
POLB P06746 3/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
LMNA P02545 3/20 0.35
RXFP1 Q9HBX9 1/20 0.35
MAPT P10636 2/20 0.35
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL6776054 1.00 KDM4E (0.39) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6775585 0.91 SMN1; SMN2 (0.45) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6775582 0.91 SMN1; SMN2 (0.45) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6771330 0.90 HSD17B10 (0.41) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6771328 0.90 HSD17B10 (0.41) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6770755 0.89 KDM4E (0.51) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL6770752 0.89 KDM4E (0.51) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL6775464 0.88 APP (0.38) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6775474 0.88 APP (0.38) KDM4EHSD17B10SMN1; SMN2POLBHPGD
SCHEMBL6773453 0.88 KDM4E (0.49) KDM4EHSD17B10SMN1; SMN2POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225145-A1 Carboxylic acid derivative and a pharmaceutical composition containing the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. 2003-12-04 US claimed
US-6589969-B1 A peroxisome proliferator activated receptor regulator containing a compound of formula (I) Because of having an effect of regulating PPAR, a compound of formula (I) is useful as a hypoglycemic agent, a hypolipidemic agent, a preventive ONO PHARMACEUTICAL CO., LTD. (JP) 2003-07-08 US claimed
EP-1122255-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-08-08 EP claimed
US-6821994-B2 A PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR REGULATOR, AN OXAZOL-4-YL-METHYLFURAN-2-YL-2-PROPENYLTHIO- OR SULFONYL- OR SULFINYL-ACETIC ACID OR METHYL ESTER ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-23 US disclosed
US-20030225145-A1 Carboxylic acid derivative and a pharmaceutical composition containing the derivative as active ingredient ONO PHARMACEUTICAL CO., LTD. 2003-12-04 US disclosed
US-6589969-B1 A peroxisome proliferator activated receptor regulator containing a compound of formula (I) Because of having an effect of regulating PPAR, a compound of formula (I) is useful as a hypoglycemic agent, a hypolipidemic agent, a preventive ONO PHARMACEUTICAL CO., LTD. (JP) 2003-07-08 US disclosed
EP-1122255-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-08-08 EP 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-20030225145-A1 Carboxylic acid derivative and a pharmaceutical composition containing the derivative as active ingredient PPARA, PPARG, PPARD KDM4E 2139/4885HSD17B10 111/4885SMN1; SMN2 4662/4885

“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.