SCHEMBL9024482

SCHEMBL9024482

CCOC(=O)C=Cc1cc[c]cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.68
CA1 P00915 1/20 0.68
CA2 P00918 1/20 0.68
CA7 P43166 1/20 0.68
CA9 Q16790 1/20 0.68
CA14 Q9ULX7 1/20 0.68
CYP3A4 P08684 1/20 0.59
TTR P02766 1/20 0.58
DPP4 P27487 1/20 0.58
MAOB P27338 1/20 0.52
FDPS P14324 1/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
PTGS2 P35354 1/20 0.47
LMNA P02545 1/20 0.46
ESR1 P03372 1/20 0.46
POLB P06746 1/20 0.46
ALOX5 P09917 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45

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
SCHEMBL20448340 1.00 CA12 (0.68) CA12CA1CA2CA7CA9
SCHEMBL13957401 0.87 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL10939791 0.87 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL5059085 0.87 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL1260527 0.85 CA12 (0.83) CA12CA1CA2CA7CA9
SCHEMBL3143890 0.85 CA12 (0.83) CA12CA1CA2CA7CA9
Ethyl Cinnamate SCHEMBL27872803 0.84 CA12 (0.70) CA12CA1CA2CA7CA9
Ethyl Cinnamate SCHEMBL1866942 0.82 CA12 (0.72) CA12CA1CA2CA7CA9
SCHEMBL1894065 0.82 CA12 (0.77) CA12CA1CA2CA7CA9
Ethyl Cinnamate SCHEMBL12001792 0.82 CA12 (0.72) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180265467-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS SELVITA S.A. (PL) 2018-09-20 US claimed
EP-3356331-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS Selvita S.A. (PL) 2018-08-08 EP claimed
US-20180265467-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS SELVITA S.A. (PL) 2018-09-20 US disclosed
EP-3356331-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS Selvita S.A. (PL) 2018-08-08 EP disclosed
EP-0398179-B1 Rhodanine derivatives and pharmaceutical compositions NISSHIN FLOUR MILLING CO (JP) 1996-01-17 EP disclosed
EP-0619313-A1 LITHIUM SALT OF 2-O-ALKYLASCORBIC ACID TSUMURA & CO. (JP) 1994-10-12 EP disclosed
US-5116855-A Aldose reductase inhibitors; antidiabetic agents NISSHIN FLOUR MILLING CO., LTD. (JP) 1992-05-26 US disclosed
CN-1014409-B Process for producing ascorbic acid derivative TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1991-10-23 CN disclosed
CN-86103398-A Produce the method for ascorbic acid derivates 1986-12-03 CN disclosed
EP-0202589-A2 Pharmaceutical compositions containing ascorbic acid derivatives Takeda Chemical Industries, Ltd. (JP) 1986-11-26 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-20180265467-A1 PYRAZOLIDINE DERIVATIVES AND RELATED COMPOUNDS LDHB, LDHA, PDK1 CA12 1267/4885CA1 980/4885CA2 501/4885

“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.