SCHEMBL10196332

SCHEMBL10196332

COc1cc(C)cc(OC)c1OC1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.50
ACHE P22303 1/20 0.48
PDE4D Q08499 6/20 0.43
PDE4A P27815 4/20 0.43
PDE4B Q07343 4/20 0.43
PDE4C Q08493 4/20 0.43
PDE10A Q9Y233 1/20 0.40
KMT2A Q03164 1/20 0.39
PTAFR P25105 2/20 0.39
PIK3R1 P27986 1/20 0.38
PIK3CA P42336 1/20 0.38
MAPT P10636 1/20 0.37
KAT2B Q92831 1/20 0.37
BAZ2B Q9UIF8 1/20 0.37
CACNB4 O00305 1/20 0.37
CACNA1A O00555 1/20 0.37
CACNA1G O43497 1/20 0.37
CACNG3 O60359 1/20 0.37
CACNA1F O60840 1/20 0.37
CACNA1H O95180 1/20 0.37

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
SCHEMBL10195820 0.81 CHEK1 (0.43) SYKPDE4DPDE4APDE4BPDE4C
SCHEMBL10196382 0.80 SYK (0.67) SYKACHEPDE4DPDE4APDE4B
SCHEMBL18481754 0.76 SYK (0.49) SYKPDE4DPDE4APDE4BPDE4C
SCHEMBL12801197 0.75 PDE4D (0.38) SYKPDE4DPDE4APDE4BPDE4C
SCHEMBL12801199 0.75 KMT2A (0.40) SYKPDE4DPDE4APDE4BPDE4C
SCHEMBL15033946 0.73 PIK3CA (0.49) SYKPIK3R1PIK3CA
SCHEMBL12448339 0.72 TBK1 (0.43) PDE4DPDE4APDE4BPDE4C
SCHEMBL1667476 0.72 TBK1 (0.43) PDE4DPDE4APDE4BPDE4CKMT2A
SCHEMBL13415003 0.72 SYK (0.43) SYKPDE4DPDE4APDE4BPDE4C
SCHEMBL12180595 0.71 PDE4D (0.58) SYKACHEPDE4DPDE4APDE4B

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
US-9187478-B2 Substituted naphthyridines and their use as medicaments Boehringer Ingellheim International GmbH (DE) 2015-11-17 US disclosed
US-20150126503-A1 SUBSTITUTED NAPHTHYRIDINES AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2015-05-07 US disclosed
US-8969568-B2 Substituted naphthyridines and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2015-03-03 US disclosed
US-20120028939-A1 SUBSTITUTED NAPHTHYRIDINES AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-02-02 US disclosed
WO-2011092128-A1 SUBSTITUTED NAPHTHYRIDINES AND THEIR USE AS SYK KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-04 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 (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-20120028939-A1 SUBSTITUTED NAPHTHYRIDINES AND THEIR USE AS MEDICAMENTS NR4A3, NR0B1, NR4A1 SYK 3856/4885ACHE 1308/4885PDE4D 1389/4885
US-20150126503-A1 SUBSTITUTED NAPHTHYRIDINES AND THEIR USE AS MEDICAMENTS NR4A3, NR0B1, NR4A1 SYK 3856/4885ACHE 1308/4885PDE4D 1389/4885

“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.