SCHEMBL3551597

SCHEMBL3551597

COC(=O)CN1CCNC(C)(C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.36
CACNA1H O95180 1/20 0.36
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.34
KMT2A Q03164 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
OPRL1 P41146 4/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
KAT2B Q92831 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL3541459 0.83 CACNA1B (0.36) CACNA1BCACNA1HKDM4ESMN1; SMN2KMT2A
SCHEMBL3553474 0.81 KMT2A (0.47) CACNA1BCACNA1HKDM4ELMNAKMT2A
SCHEMBL3553015 0.81 POLB (0.40) CACNA1BCACNA1HKMT2AOPRL1OPRM1
SCHEMBL3541852 0.81 ACE (0.39) CACNA1BCACNA1HTP53KMT2AMEN1
SCHEMBL3548171 0.80 TSHR (0.43) CACNA1BCACNA1HKDM4EKMT2AOPRL1
SCHEMBL3545734 0.79 CACNA1H (0.33) CACNA1BCACNA1HKMT2A
SCHEMBL3547090 0.77 CACNA1H (0.36) CACNA1BCACNA1HKMT2AOPRL1OPRM1
SCHEMBL27491093 0.73 KMT2A (0.36) KDM4ELMNAKMT2ACYP3A4CYP2D6
SCHEMBL3542513 0.73 OPRM1 (0.40) CACNA1BKDM4ELMNATP53KMT2A
SCHEMBL3546635 0.73 CACNA1H (0.39) CACNA1BCACNA1HKDM4ELMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741479-B2 Urea inhibitors of MAP kinases LOCUS PHARMACEUTICALS, INC. (US) 2010-06-22 US disclosed
US-20060167247-A1 Urea inhibitors of MAP kinases LOCUS PHARMACEUTICALS, INC. 2006-07-27 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-20060167247-A1 Urea inhibitors of MAP kinases MAPK1, MAP3K1, MAP3K20 CACNA1B 4869/4885CACNA1H 4873/4885KDM4E 1734/4885

“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.