SCHEMBL19946159

SCHEMBL19946159

Cc1cc2c3ccc(O)cc3c(=O)n(C)c2cn1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 5/20 0.52
TTR P02766 1/20 0.39
CYP2C9 P11712 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
ESR1 P03372 3/20 0.38
ESR2 Q92731 3/20 0.38
PDE2A O00408 1/20 0.36
BCHE P06276 2/20 0.36
ACHE P22303 2/20 0.36
ESRRA P11474 1/20 0.35
CSNK2A1 P68400 1/20 0.35
PGR P06401 1/20 0.34
NR1H3 Q13133 1/20 0.34
WEE1 P30291 1/20 0.34
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PRKDC P78527 1/20 0.33
SYK P43405 1/20 0.33

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
SCHEMBL19946180 0.83 AAK1 (0.52) AAK1
SCHEMBL26768260 0.78 CYP2C9 (0.50) TTRCYP2C9HCAR2ESR1ESR2
SCHEMBL30777875 0.78 CYP2C9 (0.50) TTRCYP2C9HCAR2ESR1ESR2
SCHEMBL19946092 0.78 AAK1 (0.43) AAK1
SCHEMBL26777410 0.78 ESR1 (0.46) TTRCYP2C9HCAR2ESR1ESR2
SCHEMBL26768903 0.77 TTR (0.46) TTRCYP2C9HCAR2ESR1ESR2
SCHEMBL19946131 0.76 AAK1 (0.58) AAK1ACHE
SCHEMBL12382830 0.74 AAK1 (0.39) AAK1BCHEACHE
SCHEMBL26767826 0.73 ESR1 (0.41) TTRCYP2C9HCAR2ESR1ESR2
SCHEMBL26767545 0.73 TTR (0.48) TTRCYP2C9HCAR2ESR1ACHE

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-3292124-B1 6H-ISOCHROMENO[3,4-C]PYRIDINES AND BENZO[C][1,7]NAPHTHYRIDIN-6-(5H)-ONES AS ADAPTOR ASSOCIATED KINASE 1 (AAK1) INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-05-22 EP disclosed
EP-3292124-B1 6H-ISOCHROMENO[3,4-C]PYRIDINES AND BENZO[C][1,7]NAPHTHYRIDIN-6-(5H)-ONES AS ADAPTOR ASSOCIATED KINASE 1 (AAK1) INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-05-22 EP disclosed
US-10174044-B2 Fused pyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-01-08 US disclosed
US-10174044-B2 Fused pyridines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-01-08 US disclosed
US-20180141956-A1 FUSED PYRIDINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-24 US disclosed
US-20180141956-A1 FUSED PYRIDINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-24 US disclosed
US-20180141956-A1 FUSED PYRIDINES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-24 US disclosed
EP-3292124-A2 FUSED PYRIDINES AS ADAPTOR ASSOCIATED KINASE 1 (AAK1) INHIBITORS Bristol-Myers Squibb Company (US) 2018-03-14 EP 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 (2 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-10174044-B2 Fused pyridines as kinase inhibitors AAK1, NCK1, ADCK1 AAK1 1/4885TTR 4789/4885CYP2C9 4838/4885
US-20180141956-A1 FUSED PYRIDINES AS KINASE INHIBITORS AAK1, NCK1, ADCK1 AAK1 1/4885TTR 4789/4885CYP2C9 4838/4885

“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.