SCHEMBL1037761

SCHEMBL1037761

O=C(Cn1cnc2ccccc21)Nc1nc(-c2ccccn2)cs1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.62
▸ ALOX15 P16050 1/20 0.62
▸ ALDH1A1 P00352 7/20 0.57
▸ SMN1; SMN2 Q16637 4/20 0.57
▸ LMNA P02545 4/20 0.57
▸ HTT P42858 2/20 0.57
▸ HPGD P15428 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ MAPT P10636 5/20 0.56
▸ POLB P06746 3/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ GAA P10253 1/20 0.56
▸ ADORA3 P0DMS8 4/20 0.55
▸ KDM4A O75164 1/20 0.55
▸ KDM4B O94953 1/20 0.55
▸ KDM5B Q9UGL1 1/20 0.55
▸ WNT3A P56704 1/20 0.54
▸ MEN1 O00255 1/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53

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
SCHEMBL5419968 0.89 KDM4E (0.52) KDM4EALOX15ALDH1A1SMN1; SMN2LMNA
SCHEMBL2825544 0.87 MAPT (0.64) KDM4EALOX15ALDH1A1SMN1; SMN2LMNA
SCHEMBL18997299 0.87 ALDH1A1 (0.68) KDM4EALOX15ALDH1A1SMN1; SMN2LMNA
SCHEMBL2826777 0.83 NPSR1 (0.66) KDM4EALOX15ALDH1A1SMN1; SMN2LMNA
SCHEMBL2829180 0.83 MAPT (0.60) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL2827972 0.83 MAPT (0.59) ALOX15ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL18997297 0.82 KDM4E (0.62) KDM4EALOX15ALDH1A1SMN1; SMN2LMNA
SCHEMBL2831060 0.81 TRPA1 (0.58) KDM4EALOX15ALDH1A1SMN1; SMN2HPGD
SCHEMBL2827630 0.81 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2LMNAHTTKMT2A
SCHEMBL2830357 0.81 TRPA1 (0.58) KDM4EALOX15ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948616-B1 2-(BENZIMIDAZOL-1-YL)-ACETAMIDE BIARYL DERIVATIVES AND THEIR USE AS INHIBITORS OF THE TRPV1 RECEPTOR ORGANON NV (NL) 2011-01-26 — — EP claimed
EP-1948616-A1 2-(BENZIMIDAZOL-1-YL)-ACETAMIDE BIARYL DERIVATIVES AND THEIR USE AS INHIBITORS OF THE TRPV1 RECEPTOR N.V. Organon (NL) 2008-07-30 — — EP claimed
WO-2007054480-A1 2-(BENZIMIDAZOL-1-YL)-ACETAMIDE BIARYL DERIVATIVES AND THEIR USE AS INHIBITORS OF THE TRPV1 RECEPTOR N.V. ORGANON (NL) 2007-05-18 — — WO claimed
EP-1948616-B1 2-(BENZIMIDAZOL-1-YL)-ACETAMIDE BIARYL DERIVATIVES AND THEIR USE AS INHIBITORS OF THE TRPV1 RECEPTOR ORGANON NV (NL) 2011-01-26 — — EP disclosed
US-7482469-B2 2-(benzimidazol-1-yl)-acetamide bisaryl derivatives N.V. ORGANON (NL) 2009-01-27 — — US disclosed
EP-1948616-A1 2-(BENZIMIDAZOL-1-YL)-ACETAMIDE BIARYL DERIVATIVES AND THEIR USE AS INHIBITORS OF THE TRPV1 RECEPTOR N.V. Organon (NL) 2008-07-30 — — EP disclosed
WO-2007054480-A1 2-(BENZIMIDAZOL-1-YL)-ACETAMIDE BIARYL DERIVATIVES AND THEIR USE AS INHIBITORS OF THE TRPV1 RECEPTOR N.V. ORGANON (NL) 2007-05-18 — — WO disclosed
US-20070112034-A1 2-(benzimidazol-1-yl)-acetamide bisaryl derivatives AKZO NOBEL N.V. (NL) 2007-05-17 — — 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-20070112034-A1 2-(benzimidazol-1-yl)-acetamide bisaryl derivatives TRPV1, TRPV3, TRPV2 KDM4E 4243/4885ALOX15 1176/4885ALDH1A1 546/4885

“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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