SCHEMBL4039705

SCHEMBL4039705

CC(C)(C)OC(=O)N1CCn2c(-c3ccccc3)cc(C#N)c2C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.42
GPR119 Q8TDV5 3/20 0.42
CKS1B P61024 2/20 0.41
SKP1 P63208 2/20 0.41
SKP2 Q13309 2/20 0.41
EGLN2 Q96KS0 1/20 0.41
MAPK1 P28482 1/20 0.41
KIT P10721 1/20 0.40
SCD5 Q86SK9 1/20 0.40
ESR2 Q92731 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
USP30 Q70CQ3 1/20 0.38
NR1H3 Q13133 1/20 0.38

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
SCHEMBL4040314 0.88 KIT (0.45) NR1H2GPR119KITNR1H3
SCHEMBL30736131 0.87 LMNA (0.52) NR1H2GPR119EGLN2ESR2NR1H3
SCHEMBL4041240 0.82 NR1H2 (0.44) NR1H2GPR119MAPK1ESR2NR1H3
SCHEMBL4038413 0.81 NR1H2 (0.43) NR1H2GPR119CKS1BSKP1SKP2
SCHEMBL4036821 0.81 NR1H2 (0.48) NR1H2GPR119CKS1BSKP1SKP2
SCHEMBL4038381 0.81 POLB (0.41) NR1H2GPR119EGLN2NR1H3
SCHEMBL4039386 0.79 GPR119 (0.45) NR1H2GPR119NR1H3
SCHEMBL4042906 0.78 GPR119 (0.43) NR1H2GPR119ESR2
SCHEMBL4046090 0.77 NR1H2 (0.41) NR1H2GPR119CKS1BSKP1SKP2
SCHEMBL4041790 0.77 NR1H2 (0.41) NR1H2GPR119CKS1BSKP1SKP2

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 5 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
EP-1463728-B1 FUSED CYCLIC MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL MYERS SQUIBB CO (US) 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

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 NR1H2 398/4885GPR119 770/4885CKS1B 137/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS NR1H2 322/4885GPR119 631/4885CKS1B 58/4885

“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.