SCHEMBL7119872

SCHEMBL7119872

c1ccc(-n2c(-c3ccncc3)cc3ccncc32)cc1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 13/20 0.74
▸ KCNH2 Q12809 11/20 0.74
▸ DYRK1A Q13627 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45

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
SCHEMBL16048095 0.85 AOC3 (1.00) AOC3KCNH2
SCHEMBL19219061 0.84 AOC3 (0.54) AOC3KCNH2KDM4E
SCHEMBL12091796 0.81 APP (0.53) AOC3KCNH2KDM4E
SCHEMBL14983597 0.80 AOC3 (0.51) AOC3KCNH2
SCHEMBL14975632 0.77 AOC3 (0.53) AOC3KCNH2
SCHEMBL12091794 0.77 AOC3 (0.52) AOC3KCNH2
SCHEMBL9507245 0.77 AOC3 (0.63) AOC3KCNH2
SCHEMBL22997263 0.76 AOC3 (0.55) AOC3KCNH2
SCHEMBL16052854 0.76 AOC3 (1.00) AOC3KCNH2
SCHEMBL16053662 0.76 AOC3 (1.00) AOC3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6630485-B2 For therapy of inflammatory disease SYNTEX (U.S.A.) LLC 2003-10-07 — — US disclosed
US-20030139462-A1 p38 MAP kinase inhibitors CHENG SOAN (US) 2003-07-24 — — US disclosed
US-6479507-B2 MODULATION OF THESE INFLAMMATORY CYTOKINES IS CONSIDERED ONE OF THE MOST EFFECTIVE STRATEGIES TO BLOCK CHRONIC INFLAMMATION AND HAVE POSITIVE THERAPEUTIC OUTCOMES SYNTEX (U.S.A.) LLC 2002-11-12 — — US disclosed
US-20020013354-A1 p38 map kinase inhibitors CHENG SOAN (US) 2002-01-31 — — US disclosed
US-20010044538-A1 p38 MAP kinase inhibitors CHENG SOAN (US) 2001-11-22 — — US disclosed
US-6316464-B1 P38 MAP kinase inhibitors SYNTEX (U.S.A.) LLC 2001-11-13 — — US disclosed
CN-1279682-A bicyclic kinase inhibitors HOFFMANN LA ROCHE (CH) 2001-01-10 — — CN 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 (3 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-20020013354-A1 p38 map kinase inhibitors MAPK1, MAPK8, MAP3K1 AOC3 3969/4885KCNH2 4088/4885DYRK1A 3110/4885
US-20030139462-A1 p38 MAP kinase inhibitors MAPK1, MAPK8, MAP3K1 AOC3 3969/4885KCNH2 4088/4885DYRK1A 3110/4885
US-20010044538-A1 p38 MAP kinase inhibitors MAPK1, MAPK8, MAP3K1 AOC3 3969/4885KCNH2 4088/4885DYRK1A 3110/4885

“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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