SCHEMBL4040548

SCHEMBL4040548

CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 1/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
CACNA1A O00555 1/20 0.45
CACNA2D1 P54289 1/20 0.45
CACNB1 Q02641 1/20 0.45
ROCK2 O75116 1/20 0.43
USP30 Q70CQ3 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GPR119 Q8TDV5 1/20 0.42
ALDH1A1 P00352 2/20 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
SCHEMBL4038901 0.89 SETD7 (0.45) SETD7KDM4EUSP30MEN1KMT2A
SCHEMBL1385650 0.86 SETD7 (0.51) SETD7KDM4EPKMROCK2USP30
SCHEMBL6194002 0.86 GPR119 (0.50) SETD7ROCK2USP30MEN1KMT2A
SCHEMBL4841744 0.85 PDK1 (0.52) KDM4ECACNA1ACACNA2D1CACNB1MEN1
SCHEMBL14251810 0.84 MEN1 (0.43) SETD7KDM4ECACNA1ACACNA2D1CACNB1
SCHEMBL2865263 0.84 MEN1 (0.43) SETD7KDM4ECACNA1ACACNA2D1CACNB1
SCHEMBL6199875 0.84 GPR119 (0.54) SETD7ROCK2USP30GPR119
SCHEMBL6335353 0.83 PARP1 (0.54) CACNA1ACACNA2D1CACNB1MEN1KMT2A
SCHEMBL4043624 0.82 MEN1 (0.40) SETD7KDM4ECACNA1ACACNA2D1CACNB1
SCHEMBL4038489 0.81 POLB (0.50) MEN1KMT2AGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1436291-B1 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA SA (FR) 2009-01-14 EP disclosed
US-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 US disclosed
US-7148215-B2 Prodrugs as antihistamines or anticarcinogenic agents AVENTIS PHARMA S.A. (FR) 2006-12-12 US disclosed
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents AVENTIS PHARMA S.A, (FR) 2005-01-13 US disclosed
EP-1436291-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS Aventis Pharma S.A. (FR) 2004-07-14 EP disclosed
WO-2003024967-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA S.A. (FR) 2003-03-27 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 (2 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-20070238734-A1 JNK INHIBITORS MAP3K7, MAPKAPK2, MAPK7 SETD7 2653/4885KDM4E 2836/4885PKM 1068/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS SETD7 2544/4885KDM4E 2452/4885PKM 3366/4885

“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.