SCHEMBL6776092

SCHEMBL6776092

Cc1oc(-c2ccccc2)nc1CBr

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
HRH3 Q9Y5N1 3/20 0.56
HPGD P15428 1/20 0.55
PPARG P37231 5/20 0.50
PPARA Q07869 5/20 0.50
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
KDR P35968 1/20 0.49
LMNA P02545 1/20 0.49
PDE10A Q9Y233 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
FFAR1 O14842 1/20 0.47
HSP90AA1 P07900 1/20 0.47
PPARD Q03181 1/20 0.47
TP53 P04637 1/20 0.46
TARBP2 Q15633 1/20 0.46

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
SCHEMBL4389491 0.86 HRH3 (0.61) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL2705773 0.86 TP53 (0.49) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL266619 0.84 KDM4E (0.66) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL6383881 0.83 HRH3 (0.58) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL203871 0.83 HSD17B10 (0.53) KDM4EHPGDPPARALMNATP53
SCHEMBL503956 0.82 ALDH1A1 (0.51) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL5854753 0.82 PPARG (0.57) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL1596084 0.82 KDM4E (0.64) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL503999 0.82 KDM4E (0.64) KDM4EHRH3HPGDPPARGPPARA
SCHEMBL3756029 0.82 KDM4E (0.64) KDM4EHRH3HPGDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2139/4885HRH3 3906/4885HPGD 608/4885

“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.