SCHEMBL6771069

SCHEMBL6771069

Cc1oc(-c2ccccc2)nc1Cc1ccc(Br)o1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
PPARA Q07869 6/20 0.48
PPARG P37231 5/20 0.48
HRH3 Q9Y5N1 3/20 0.48
HPGD P15428 1/20 0.47
RAB9A P51151 5/20 0.46
NPC1 O15118 4/20 0.46
LMNA P02545 1/20 0.45
KDR P35968 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
PDE10A Q9Y233 1/20 0.42
FFAR1 O14842 1/20 0.41
MEN1 O00255 1/20 0.41
HSP90AA1 P07900 1/20 0.41
KMT2A Q03164 1/20 0.41
PPARD Q03181 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL7228161 0.80 KDM4E (0.57) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL6776301 0.80 KDM4E (0.53) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL6770398 0.78 KDM4E (0.55) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL6776092 0.77 KDM4E (0.64) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL6780825 0.77 KDM4E (0.50) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL6780817 0.77 KDM4E (0.50) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL8686674 0.77 KDM4E (0.47) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL6773338 0.76 KDM4E (0.49) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL7247816 0.76 KDM4E (0.55) KDM4EPPARAPPARGHRH3HPGD
SCHEMBL7247822 0.76 KDM4E (0.55) KDM4EPPARAPPARGHRH3HPGD

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 2139/4885PPARA 1/4885PPARG 2/4885

“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.