SCHEMBL4969811

SCHEMBL4969811

Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA9 Q16790 1/20 0.53
NR1H4 Q96RI1 5/20 0.51
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
CASR P41180 1/20 0.48
KDM4E B2RXH2 3/20 0.47
MAPT P10636 2/20 0.47
HSD17B10 Q99714 2/20 0.47
POLB P06746 2/20 0.47
MEN1 O00255 1/20 0.47
CYP2D6 P10635 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
CYP1A2 P05177 1/20 0.46
PSMB8 P28062 1/20 0.44
ALDH1A1 P00352 3/20 0.43
ACHE P22303 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL30258184 1.00 CA12 (0.53) CA12CA1CA9NR1H4PPARG
SCHEMBL509152 0.88 CA12 (0.53) CA12CA1CA9NR1H4PPARG
SCHEMBL16412251 0.88 KDM4E (0.49) CA12CA1CA9KDM4EMAPT
SCHEMBL4984917 0.87 CA12 (0.52) CA12CA1CA9MAPTMEN1
SCHEMBL30339301 0.85 KDM4E (0.64) CA12CA1CA9KDM4EMAPT
SCHEMBL596681 0.85 KDM4E (0.64) CA12CA1CA9KDM4EMAPT
SCHEMBL13197992 0.84 CA12 (0.58) CA12CA1CA9KDM4EMAPT
SCHEMBL1854623 0.84 MAPT (0.54) CA12CA1CA9NR1H4PPARG
SCHEMBL19233276 0.84 KDM4E (0.46) CA12CA1CA9PPARAKDM4E
SCHEMBL28609147 0.84 KDM4E (0.46) CA12CA1CA9KDM4EMAPT

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
CN-118047718-A Antiviral heterocyclic skeleton derivative, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2024-05-17 CN disclosed
US-20080312206-A1 Chemical Compounds-149 ASTRAZENECA AB (SE) 2008-12-18 US disclosed
EP-1966174-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2008-09-10 EP disclosed
WO-2007071955-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2007-06-28 WO 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-20080312206-A1 Chemical Compounds-149 CSF3R, CSF1R, FLT3 CA12 1758/4885CA1 994/4885CA9 916/4885

“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.