SCHEMBL712394

SCHEMBL712394

CC(C)Oc1ccc(NC(=O)C2CCCC(O)C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELOVL6 Q9H5J4 4/20 0.52
GLA P06280 2/20 0.50
TP53 P04637 3/20 0.49
ENPP3 O14638 2/20 0.48
ENPP1 P22413 2/20 0.48
ENPP2 Q13822 1/20 0.46
ALDH1A1 P00352 4/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 2/20 0.45
USP2 O75604 1/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
STS P08842 1/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 1/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
PTPN1 P18031 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL13090477 0.85 ENPP3 (0.64) ELOVL6GLAENPP3ENPP1ENPP2
SCHEMBL708780 0.83 ENPP3 (0.54) ELOVL6GLATP53ENPP3ENPP1
SCHEMBL711630 0.79 TP53 (0.46) ELOVL6GLATP53ENPP3ENPP1
SCHEMBL2853568 0.79 ENPP3 (0.54) ELOVL6TP53ENPP3ENPP1ENPP2
SCHEMBL2846099 0.79 ENPP3 (0.54) ELOVL6TP53ENPP3ENPP1ENPP2
SCHEMBL2846095 0.79 ENPP3 (0.54) ELOVL6TP53ENPP3ENPP1ENPP2
SCHEMBL13135944 0.79 ENPP3 (0.54) ELOVL6TP53ENPP3ENPP1ENPP2
SCHEMBL710497 0.79 TP53 (0.54) ELOVL6GLATP53ENPP3ENPP1
SCHEMBL2847008 0.78 ELOVL6 (0.49) ELOVL6TP53ENPP3ENPP1ENPP2
SCHEMBL2847007 0.78 ELOVL6 (0.49) ELOVL6TP53ENPP3ENPP1ENPP2

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
EP-2236494-B1 SULFONYL SUBSTITUTED 6-MEMBERED RING DERIVATIVE MSD KK (JP) 2016-08-31 EP disclosed
US-8124807-B2 Sulfonyl-substituted 6-membered ring derivative MSD K.K. (JP) 2012-02-28 US disclosed
EP-2236494-A1 SULFONYL SUBSTITUTED 6-MEMBERED RING DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-10-06 EP disclosed
US-20100249147-A1 SULFONYL-SUBSTITUTED 6-MEMBERED RING DERIVATIVE MSD K.K. (JP) 2010-09-30 US 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-20100249147-A1 SULFONYL-SUBSTITUTED 6-MEMBERED RING DERIVATIVE CHRM2, CHRM3, CHRM1 ELOVL6 3399/4885GLA 2967/4885TP53 3099/4885

“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.