SCHEMBL4332256

SCHEMBL4332256

Bc1cccc(CC(OC(C)C)C(=O)OCC)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
MAPK1 P28482 2/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
LMNA P02545 1/20 0.36
MEP1B Q16820 1/20 0.36
PPARG P37231 4/20 0.36
PPARA Q07869 3/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NLRP3 Q96P20 1/20 0.34

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
SCHEMBL4332258 0.85 GRIA2 (0.42) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL4329899 0.85 MMP8 (0.39) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL4332255 0.85 GRIA2 (0.42) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL13819361 0.84 CYP4F2 (0.41) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL4334347 0.84 SMN1; SMN2 (0.40) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL13810212 0.84 LOXL2 (0.41) MMP8L3MBTL1MAPK1TSHRTDP1
Hydrochloric Acid SCHEMBL4332232 0.83 LOXL2 (0.40) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL4332596 0.83 CYP4F2 (0.45) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL6720362 0.83 MAPK1 (0.40) MMP8L3MBTL1MAPK1TSHRTDP1
SCHEMBL4327282 0.83 ALDH1A1 (0.46) TSHRALDH1A1CYP4F2CYP4A11MEP1B

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 MMP8 2034/4885L3MBTL1 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.