SCHEMBL13640438

SCHEMBL13640438

Cc1ccc(NC=C2C(=O)CC(C)(C)CC2=O)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ OPRM1 P35372 3/20 0.43
▸ MAPT P10636 4/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ KMT2A Q03164 6/20 0.41
▸ KDM4E B2RXH2 5/20 0.41
▸ LMNA P02545 3/20 0.41
▸ HTT P42858 2/20 0.41
▸ BRD4 O60885 1/20 0.39
▸ RAPGEF4 Q8WZA2 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 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
SCHEMBL18871410 0.83 ALDH1A1 (0.38) ALDH1A1HSD17B10OPRM1MAPTNPC1
SCHEMBL18871411 0.81 ALDH1A1 (0.34) ALDH1A1HSD17B10OPRM1MAPTNPC1
SCHEMBL18870976 0.80 ALDH1A1 (0.34) ALDH1A1HSD17B10MAPTNPC1RAB9A
SCHEMBL13640138 0.78 KMT2A (0.49) ALDH1A1MAPTNPC1RAB9AGAA
SCHEMBL13640143 0.77 ALDH1A1 (0.46) ALDH1A1HSD17B10MAPTNPC1RAB9A
SCHEMBL13640170 0.73 RAB9A (0.58) ALDH1A1MAPTNPC1RAB9AGAA
SCHEMBL13640179 0.72 ALDH1A1 (0.42) ALDH1A1HSD17B10MAPTGAAHPGD
SCHEMBL13640140 0.71 PKM (0.46) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL13640156 0.71 BUB1 (0.45) ALDH1A1OPRM1MAPTHPGDMEN1
SCHEMBL18871544 0.71 ALDH1A1 (0.41) ALDH1A1HSD17B10MAPTHPGDMEN1

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-2477491-B1 PLANT ADDITIVES AND USES THEREOF TO MODULATE THE SYNTHESIS OF MEMBRANE GLYCEROLIPIDS IN PLANTS COMMISSARIAT L ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-05-17 — — EP disclosed
US-9028855-B2 Plant additives and uses thereof to modulate the synthesis of membrane glycerolipids in planta COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2015-05-12 — — US disclosed
US-9028855-B2 Plant additives and uses thereof to modulate the synthesis of membrane glycerolipids in planta COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2015-05-12 — — US disclosed
US-20120283101-A1 Plant Additives and Uses Thereof to Modulate the Synthesis of Membrane Glycerolipids in Planta COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2012-11-08 — — 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-20120283101-A1 Plant Additives and Uses Thereof to Modulate the Synthesis of Membrane Glycerolipids in Planta PGM2, SGMS2, PHOSPHO1 ALDH1A1 3248/4885HSD17B10 1061/4885OPRM1 2668/4885

“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.

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