SCHEMBL4430780

SCHEMBL4430780

COc1ccc(Nc2ccn[nH]2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.55
▸ RAB9A P51151 4/20 0.55
▸ GAA P10253 3/20 0.55
▸ NPC1 O15118 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ TDP1 Q9NUW8 2/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ THRB P10828 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ SCN4A P35499 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.50
▸ HTT P42858 1/20 0.50
▸ ADRA2A P08913 1/20 0.49
▸ ADRA2B P18089 1/20 0.49
▸ ADRA2C P18825 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ NR4A1 P22736 1/20 0.47
▸ PDPK1 O15530 1/20 0.47

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
SCHEMBL1372198 0.81 ADRA2A (0.46) MAPTRAB9ANPC1MAPK1L3MBTL1
SCHEMBL1491116 0.79 HAO1 (0.46) MAPTRAB9ANPC1SMN1; SMN2PTGIR
SCHEMBL27863099 0.79 CYP1A2 (0.51) MAPTRAB9AGAANPC1MAPK1
SCHEMBL4286115 0.78 KDR (0.54) MAPTRAB9AGAANPC1MAPK1
SCHEMBL27700384 0.76 GSK3A (0.43) MAPTRAB9AGAANPC1MAPK1
SCHEMBL21725013 0.75 POLB (0.52) MAPTRAB9AGAANPC1MAPK1
SCHEMBL39057 0.73 MAPT (1.00) MAPTRAB9AGAANPC1MAPK1
SCHEMBL1459772 0.73 MAPT (1.00) MAPTRAB9AGAANPC1MAPK1
SCHEMBL7330497 0.71 RAB9A (0.74) MAPTRAB9AGAANPC1MAPK1
SCHEMBL28142607 0.69 RAB9A (0.64) MAPTRAB9AGAANPC1MAPK1

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-2118067-A1 NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS Siena Biotech S.p.A. (IT) 2009-11-18 — — EP disclosed
US-20080300263-A1 Pyrazolo [1,5-a] pyrimidine compounds and pharmaceutical compositions containing them EIRX THERAPEUTICS PLC (IE) 2008-12-04 — — US disclosed
WO-2008087529-A1 NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS SIENA BIOTECH S.P.A. (IT) 2008-07-24 — — WO disclosed
EP-1922321-A1 PYRAZOLOÝ1,5-A¨PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Eirx Therapeutics Ltd (IE) 2008-05-21 — — EP disclosed
WO-2007017678-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM EIRX THERAPEUTICS LIMITED (IE) 2007-02-15 — — 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-20080300263-A1 Pyrazolo [1,5-a] pyrimidine compounds and pharmaceutical compositions containing them DPYD, TYMS, TYMP MAPT 3329/4885RAB9A 1434/4885GAA 2047/4885

“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.

Send feedback