SCHEMBL1406015

SCHEMBL1406015

Nc1ccc(CCN2CCC(CNC(=O)c3n[nH]c4ccccc34)CC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 18/20 0.68
▸ CDK2 P24941 1/20 0.65
▸ CDK16 Q00536 1/20 0.65
▸ DYRK1A Q13627 1/20 0.65
▸ HTR2A P28223 2/20 0.63
▸ HTR4 Q13639 2/20 0.63
▸ KCNH2 Q12809 1/20 0.63

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
Hydrochloric Acid SCHEMBL1406006 0.99 GSK3B (0.67) GSK3BCDK2CDK16DYRK1AHTR2A
SCHEMBL19101740 0.91 GSK3B (0.68) GSK3BCDK2CDK16DYRK1AHTR2A
SCHEMBL1405918 0.87 GSK3B (0.72) GSK3BCDK2CDK16DYRK1AHTR2A
Hydrochloric Acid SCHEMBL1405699 0.87 GSK3B (0.71) GSK3BCDK2CDK16DYRK1AHTR2A
SCHEMBL6952214 0.82 GSK3B (0.62) GSK3BHTR2A
SCHEMBL16321074 0.82 GSK3B (0.75) GSK3BHTR4
SCHEMBL6957369 0.82 GSK3B (0.70) GSK3BDYRK1A
SCHEMBL16322572 0.81 GSK3B (1.00) GSK3BCDK2CDK16DYRK1A
SCHEMBL30068530 0.80 RAB9A (0.61) GSK3BCDK2DYRK1AKCNH2
SCHEMBL5433264 0.80 RAB9A (0.61) GSK3BCDK2DYRK1AKCNH2

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
EP-1622892-B1 INDAZOLES HAVING ANALGESIC ACTIVITY ACRAF (IT) 2011-03-09 — — EP claimed
US-7662836-B2 Indazole having analgesic activity AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2010-02-16 — — US claimed
US-20070010555-A1 Indazole having analgesic activity AZIENDE CHIM. RUIN. ANGEL. FRA. A.C.R.A.F. S.P.A. (IT) 2007-01-11 — — US claimed
EP-1622892-A1 INDAZOLES HAVING ANALGESIC ACTIVITY AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.p.A. (IT) 2006-02-08 — — EP claimed
WO-2004101548-A1 INDAZOLE HAVING ANALGESIC ACTIVITY , AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2004-11-25 — — WO claimed

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-20070010555-A1 Indazole having analgesic activity ACHE, CYP3A43, RPL35A GSK3B 2637/4885CDK2 2456/4885CDK16 3240/4885

“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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