SCHEMBL5836712

SCHEMBL5836712

Cc1cccc(CC(=O)c2ccc3c(c2)n(C)c(=O)n3C2CCCC2)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPD P32754 3/20 0.50
PIK3CA P42336 6/20 0.46
PRKDC P78527 6/20 0.46
NPC1 O15118 1/20 0.42
MTOR P42345 3/20 0.41
HSD11B1 P28845 2/20 0.41
POLB P06746 2/20 0.41
ALDH1A1 P00352 3/20 0.40
PKM P14618 1/20 0.40
DRD2 P14416 1/20 0.40
SLC6A4 P31645 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
KMT2A Q03164 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
SCHEMBL5838037 0.85 HPD (0.48) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5837660 0.78 HPD (0.47) HPDPOLBALDH1A1PKMMAPT
SCHEMBL5836721 0.78 HPD (0.48) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5836717 0.78 HPD (0.48) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5836775 0.77 HPD (0.50) HPDNPC1POLBALDH1A1PKM
SCHEMBL6208794 0.75 HPD (0.56) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5836683 0.74 KDM4E (0.50) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5836096 0.73 HPD (0.52) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5836181 0.72 HPD (0.53) HPDPIK3CAPRKDCMTORHSD11B1
SCHEMBL5838065 0.71 HPD (0.41) HPDPIK3CAPRKDCMTORHSD11B1

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 4598/4885PIK3CA 1672/4885PRKDC 1727/4885

“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.