SCHEMBL5836096

SCHEMBL5836096

CON(C)C(=O)c1ccc2c(c1)n(C)c(=O)n2C1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPD P32754 3/20 0.52
HSD11B1 P28845 2/20 0.46
PIK3CA P42336 10/20 0.44
PRKDC P78527 8/20 0.44
MTOR P42345 4/20 0.41
DRD2 P14416 1/20 0.41
SLC6A4 P31645 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
BRD4 O60885 1/20 0.40
ALDH1A1 P00352 1/20 0.40
BRPF1 P55201 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL5836181 0.81 HPD (0.53) HPDHSD11B1PIK3CAPRKDCMTOR
SCHEMBL6208794 0.79 HPD (0.56) HPDHSD11B1PIK3CAPRKDCMTOR
SCHEMBL5836240 0.78 ALDH1A1 (0.58) HSD11B1DRD2SLC6A4SMN1; SMN2KDM4E
SCHEMBL5836092 0.77 HPD (0.50) HPDHSD11B1PIK3CAPRKDCMTOR
SCHEMBL6054650 0.76 HPD (0.48) HPDSMN1; SMN2KDM4EBRD4ALDH1A1
SCHEMBL989522 0.75 L3MBTL1 (0.41) KDM4EALDH1A1
SCHEMBL5838497 0.74 HPD (0.44) HPDHSD11B1PIK3CAPRKDCMTOR
SCHEMBL5836712 0.73 HPD (0.50) HPDHSD11B1PIK3CAPRKDCMTOR
SCHEMBL3605908 0.72 HTR1A (0.44) SMN1; SMN2KDM4EBRD4ALDH1A1
SCHEMBL5836717 0.69 HPD (0.48) HPDHSD11B1PIK3CAPRKDCMTOR

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
US-7056918-B2 Benzimidazole anti-inflammatory compounds PFIZER, INC. (US) 2006-06-06 US disclosed
EP-1370557-B1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2005-11-16 EP disclosed
EP-1370557-A1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS Pfizer Products Inc. (US) 2003-12-17 EP disclosed
US-20030092749-A1 Novel benzimidazole anti-inflammatory compounds PFIZER INC. 2003-05-15 US disclosed
WO-2002072576-A1 BENZIMIDAZOLE ANTI-INFLAMMATORY COMPOUNDS PFIZER PRODUCTS INC. (US) 2002-09-19 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 (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-20030092749-A1 Novel benzimidazole anti-inflammatory compounds MAPK1, JAK1, CNKSR1 HPD 4598/4885HSD11B1 3213/4885PIK3CA 1672/4885

“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.