SCHEMBL13640141

SCHEMBL13640141

CC1(C)CC(=O)C(=CNc2ccc(F)cc2)C(=O)C1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.60
▸ TSHR P16473 1/20 0.60
▸ MAPT P10636 3/20 0.40
▸ CYP11B2 P19099 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ BUB1 O43683 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ HIF1A Q16665 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 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
SCHEMBL13640138 0.85 KMT2A (0.49) ALDH1A1TSHRMAPTCYP11B2HPGD
SCHEMBL12830161 0.85 ALDH1A1 (0.43) ALDH1A1TSHRMAPTBUB1KDM4E
SCHEMBL8428005 0.84 MAPT (0.51) ALDH1A1TSHRMAPTHPGDKDM4E
SCHEMBL22057718 0.84 MAOA (0.45) ALDH1A1TSHRMAPTCYP11B2HPGD
SCHEMBL13640189 0.84 NTRK3 (0.43) ALDH1A1TSHRMAPTHPGDKDM4E
SCHEMBL13640144 0.84 ALDH1A1 (0.42) ALDH1A1TSHRMAPTHPGDBUB1
SCHEMBL11109819 0.83 ALDH1A1 (0.60) ALDH1A1TSHRMAPTL3MBTL1KMT2A
SCHEMBL13640151 0.83 BUB1 (0.43) ALDH1A1TSHRMAPTCYP11B2HPGD
SCHEMBL12316747 0.81 ALDH1A1 (0.40) ALDH1A1TSHRMAPTKDM4EL3MBTL1
SCHEMBL18871421 0.81 BUB1 (0.45) ALDH1A1TSHRMAPTCYP11B2HPGD

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 5 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
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 3248/4885TSHR 3319/4885MAPT 4242/4885

“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.

Send feedback