SCHEMBL25801705

SCHEMBL25801705

CCCCCCCCc1ccnc(C(=O)OC)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.47
PPARA Q07869 4/20 0.47
PPARG P37231 3/20 0.47
PARP1 P09874 1/20 0.45
KAT8 Q9H7Z6 2/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
SMYD3 Q9H7B4 1/20 0.42
MDH1 P40925 1/20 0.42
LNPEP Q9UIQ6 1/20 0.42

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
SCHEMBL5511246 0.87 PARP1 (0.44) ARPARP1CYP4F2CYP4A11
SCHEMBL22335931 0.87 CYP4A11 (0.57) ARPARP1CYP4F2CYP4A11SMYD3
SCHEMBL5510075 0.86 PARP1 (0.45) ARPARP1CYP4F2CYP4A11SMYD3
SCHEMBL5517940 0.86 PARP1 (0.45) ARPARP1CYP4F2CYP4A11SMYD3
SCHEMBL4871286 0.85 CYP4A11 (0.54) ARPARP1CYP4F2CYP4A11SMYD3
SCHEMBL10983487 0.84 PPARA (0.54) PPARAPPARGKAT8MAPTLNPEP
SCHEMBL28019655 0.84 PPARA (0.54) PPARAPPARGKAT8MAPTLNPEP
SCHEMBL1132805 0.84 PPARA (0.54) PPARAPPARGKAT8MAPTLNPEP
SCHEMBL9096446 0.84 PPARA (0.54) PPARAPPARGKAT8MAPTLNPEP
SCHEMBL5514986 0.83 PARP1 (0.43) ARPPARAPARP1CYP4F2CYP4A11

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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 US disclosed
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 US disclosed
CN-115066418-A Carboxy derivatives with anti-inflammatory properties 西特瑞治疗有限公司 2022-09-16 CN 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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES CPA2, RO60, C5AR1 AR 3384/4885PPARA 1223/4885PPARG 715/4885

“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.