SCHEMBL6771330

SCHEMBL6771330

COC(=O)CSCC=Cc1ccc(Cc2nc(-c3ccc(N(C)C)cc3)oc2C)o1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.41
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 4/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
SMN1; SMN2 Q16637 10/20 0.39
MAPT P10636 8/20 0.39
RXFP1 Q9HBX9 1/20 0.37
POLB P06746 3/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
XBP1 P17861 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36

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
SCHEMBL6771328 1.00 HSD17B10 (0.41) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6780459 0.91 SMN1; SMN2 (0.46) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6780462 0.91 SMN1; SMN2 (0.46) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6776054 0.90 KDM4E (0.39) HSD17B10ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL6776046 0.90 KDM4E (0.39) HSD17B10ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL6776171 0.89 KDM4E (0.45) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6776165 0.89 KDM4E (0.45) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6775329 0.89 HSD17B10 (0.38) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6775324 0.89 HSD17B10 (0.38) HSD17B10ALDH1A1KDM4EHPGDKMT2A
SCHEMBL6776403 0.89 MAPT (0.49) HSD17B10ALDH1A1KDM4EHPGDKMT2A

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 HSD17B10 111/4885ALDH1A1 340/4885KDM4E 2139/4885

“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.