SCHEMBL14381920

SCHEMBL14381920

COc1ccc(NC(=O)c2ccc(-c3nc4cc(C(=O)Nc5ccc(F)cc5)ccc4[nH]3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ COMT P21964 1/20 0.60
▸ HPSE Q9Y251 7/20 0.59
▸ CHEK2 O96017 1/20 0.55
▸ PRSS12 P56730 1/20 0.54
▸ PLAU P00749 1/20 0.54
▸ MMP2 P08253 2/20 0.54
▸ MMP9 P14780 2/20 0.54
▸ MMP8 P22894 2/20 0.54
▸ MMP13 P45452 2/20 0.54
▸ MAPT P10636 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL14381528 1.00 COMT (0.60) COMTHPSECHEK2PRSS12PLAU
SCHEMBL14381916 1.00 COMT (0.60) COMTHPSECHEK2PRSS12PLAU
SCHEMBL14381770 0.95 COMT (0.66) COMTHPSECHEK2PRSS12PLAU
SCHEMBL14381764 0.92 HPSE (0.67) HPSECHEK2PRSS12MMP2MMP9
SCHEMBL14381525 0.92 HPSE (0.67) HPSECHEK2PRSS12MMP2MMP9
SCHEMBL14381881 0.91 COMT (0.70) COMTHPSECHEK2PRSS12MMP2
SCHEMBL14381555 0.91 COMT (0.70) COMTHPSECHEK2PRSS12MMP2
SCHEMBL14381860 0.91 COMT (0.70) COMTHPSECHEK2PRSS12MMP2
SCHEMBL14381567 0.90 CHEK2 (0.62) COMTHPSECHEK2PRSS12PLAU
SCHEMBL14381879 0.90 CHEK2 (0.62) COMTHPSECHEK2PRSS12PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282518-B2 Benzimidazole compounds for modulating IgE and inhibiting cellular proliferation AVANIR PHARMACEUTICALS (US) 2007-10-16 — — US disclosed
US-7282518-B2 Benzimidazole compounds for modulating IgE and inhibiting cellular proliferation AVANIR PHARMACEUTICALS (US) 2007-10-16 — — US disclosed
US-20070202133-A1 BENZIMIDAZOLE COMPOUNDS FOR MODULATING IgE AND INHIBITING CELLULAR PROLIFERATION SIRCAR JAGADISH C 2007-08-30 — — US disclosed
US-20070202133-A1 BENZIMIDAZOLE COMPOUNDS FOR MODULATING IgE AND INHIBITING CELLULAR PROLIFERATION SIRCAR JAGADISH C 2007-08-30 — — 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-20070202133-A1 BENZIMIDAZOLE COMPOUNDS FOR MODULATING IgE AND INHIBITING CELLULAR PROLIFERATION MKI67, CMA1, CCNI COMT 3739/4885HPSE 4488/4885CHEK2 2484/4885

“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.

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