SCHEMBL20149359

SCHEMBL20149359

COOCc1cnc(Cl)nc1Cl

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.33

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
SCHEMBL16796160 0.85 LMNA (0.46) KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL17581276 0.78 KDM4E (0.33) KDM4EALDH1A1SMN1; SMN2
SCHEMBL17589013 0.77 LMNA (0.33) KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL30961378 0.76 MAPKAPK2 (0.33) KDM4EALDH1A1SMN1; SMN2
SCHEMBL30961293 0.76 LMNA (0.35) KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL17581324 0.76 MAPKAPK2 (0.33) KDM4EALDH1A1SMN1; SMN2
SCHEMBL24046148 0.75 KDM4E (0.36) KDM4EALDH1A1SMN1; SMN2
SCHEMBL30961423 0.74 KDM4E (0.36) KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL30238970 0.74 NOS3 (0.36) KDM4EALDH1A1SMN1; SMN2
SCHEMBL4579208 0.74 NOS3 (0.36) KDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180133220-A1 COMPOUNDS FOR USE IN TREATING ACUTE CORONARY SYNDROME AND RELATED CONDITIONS VITAE PHARMACEUTICALS, LLC 2018-05-17 US 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-20180133220-A1 COMPOUNDS FOR USE IN TREATING ACUTE CORONARY SYNDROME AND RELATED CONDITIONS TNNI3, FABP3, TNNT2 KDM4E 4782/4885ALDH1A1 566/4885SMN1; SMN2 3787/4885

“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.