SCHEMBL2878178

SCHEMBL2878178

COC(=O)C=Cc1cnc2c(N3CCN(C(=O)OC(C)(C)C)CC3)cccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CKS1B P61024 2/20 0.46
SKP1 P63208 2/20 0.46
SKP2 Q13309 2/20 0.46
ACHE P22303 2/20 0.43
ABCB1 P08183 4/20 0.43
BACE1 P56817 2/20 0.41
PTPN11 Q06124 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
GPR119 Q8TDV5 2/20 0.40
MAP4K4 O95819 1/20 0.40
KIT P10721 2/20 0.40
SMARCA2 P51531 1/20 0.39
SMARCA4 P51532 1/20 0.39
PBRM1 Q86U86 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL2878173 1.00 KMT2A (0.49) KMT2ASMN1; SMN2KDM4ECKS1BSKP1
SCHEMBL3917775 0.86 SMN1; SMN2 (0.47) KMT2ASMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL520241 0.80 MAP4K4 (0.50) KMT2ASMN1; SMN2CKS1BSKP1SKP2
SCHEMBL520960 0.80 CKS1B (0.49) KMT2ASMN1; SMN2CKS1BSKP1SKP2
SCHEMBL2854558 0.79 HRH1 (0.47) CKS1BSKP1SKP2ACHEBACE1
SCHEMBL20128887 0.79 GPR119 (0.52) SMN1; SMN2CKS1BSKP1SKP2ABCB1
SCHEMBL20214374 0.79 GPR119 (0.52) SMN1; SMN2CKS1BSKP1SKP2ABCB1
SCHEMBL4800091 0.79 CKS1B (0.51) KMT2ACKS1BSKP1SKP2ACHE
SCHEMBL2416566 0.77 ALK (0.42) KMT2ASMN1; SMN2KDM4ECKS1BSKP1
SCHEMBL2416568 0.77 ALK (0.42) KMT2ASMN1; SMN2KDM4ECKS1BSKP1

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
EP-2027108-B1 HISTAMINE RECEPTOR ANTAGONISTS COMPRISING AN AZEPIN CORE GLAXO GROUP LTD (GB) 2010-01-13 EP disclosed
US-20090181950-A1 Histamine Receptor Antagonists Comprising an Azepin Core GLAXO GROUP LIMITED (GB) 2009-07-16 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-20090181950-A1 Histamine Receptor Antagonists Comprising an Azepin Core HRH2, HRH1, HRH4 KMT2A 1661/4885SMN1; SMN2 4830/4885KDM4E 1206/4885

“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.