SCHEMBL4336491

SCHEMBL4336491

CCOC(=O)C(Cc1cccc(OCC#Cc2ccccc2C)c1)OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
L3MBTL1 Q9Y468 4/20 0.40
MAPK1 P28482 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
TSHR P16473 2/20 0.40
PPARA Q07869 8/20 0.36
FFAR1 O14842 1/20 0.35
PPARG P37231 7/20 0.35
LMNA P02545 1/20 0.34
MME P08473 1/20 0.34
ACE P12821 1/20 0.34
CPA1 P15085 1/20 0.34
ACE2 Q9BYF1 1/20 0.34
ALDH1A1 P00352 1/20 0.34
NLRP3 Q96P20 1/20 0.33
PPARD Q03181 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GRM5 P41594 1/20 0.32

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
SCHEMBL4339926 0.82 MAPK1 (0.46) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL13810945 0.76 L3MBTL1 (0.44) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL13810477 0.76 TSHR (0.48) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL13085576 0.76 TSHR (0.48) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL13810494 0.76 TSHR (0.48) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL4558827 0.76 TSHR (0.48) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL13819365 0.76 TSHR (0.48) L3MBTL1MAPK1TDP1TSHRPPARA
SCHEMBL4336503 0.75 PPARA (0.43) ALOX5PPARAPPARGPPARD
SCHEMBL4332268 0.74 PPARA (0.44) PPARAPPARGMMEACECPA1
SCHEMBL4332264 0.74 PPARA (0.44) PPARAPPARGMMEACECPA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 ALOX5 1280/4885L3MBTL1 3856/4885MAPK1 698/4885

“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.