SCHEMBL20448490

SCHEMBL20448490

CCOC(=O)/C=C/c1[c]cccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
TTR P02766 1/20 0.47
DPP4 P27487 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MAPT P10636 5/20 0.44
LMNA P02545 4/20 0.44
MDM2 Q00987 2/20 0.44
CYP3A4 P08684 2/20 0.44
PTGS2 P35354 1/20 0.44
MAOB P27338 1/20 0.43
ALOX5 P09917 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 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
SCHEMBL6851358 0.77 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL10783189 0.76 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL11091317 0.76 GLA (0.52) NPC1RAB9AMAPTLMNAMDM2
SCHEMBL7744900 0.75 ALDH1A1 (0.49) NPC1RAB9AMAPTPTGS2ALDH1A1
SCHEMBL7744903 0.75 ALDH1A1 (0.49) NPC1RAB9AMAPTPTGS2ALDH1A1
Ethyl Cinnamate SCHEMBL12001792 0.75 CA12 (0.72) CA12CA1CA2CA7CA9
Ethyl Cinnamate SCHEMBL112445 0.75 CA12 (0.72) CA12CA1CA2CA7CA9
SCHEMBL11054639 0.75 CA12 (0.57) CA12CA1CA2CA7CA9
Ethyl Cinnamate SCHEMBL112446 0.75 CA12 (0.72) CA12CA1CA2CA7CA9
Ethyl Cinnamate SCHEMBL1866942 0.75 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 4 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

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.