SCHEMBL12085422

SCHEMBL12085422

Cc1cccc(Nc2nc(N3CCN(C)CC3)ncc2C(N)=O)c1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 13/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ AURKB Q96GD4 4/20 0.57
▸ KCNH2 Q12809 4/20 0.57
▸ ZAP70 P43403 1/20 0.57
▸ CAMK1D Q8IU85 5/20 0.54
▸ MAPK3 P27361 2/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ GP6 Q9HCN6 1/20 0.54
▸ BRD4 O60885 1/20 0.54

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
SCHEMBL12085443 0.91 SYK (0.53) SYKAURKBKCNH2CAMK1DMAPK3
SCHEMBL12085292 0.90 SYK (0.66) SYKAURKBKCNH2ZAP70CAMK1D
SCHEMBL12085393 0.88 SYK (0.53) SYKAURKBKCNH2ZAP70CAMK1D
SCHEMBL12085331 0.88 CAMK1D (0.62) SYKAURKBKCNH2CAMK1DMAPK3
SCHEMBL12085291 0.85 SYK (0.57) SYKAURKBKCNH2ZAP70CAMK1D
SCHEMBL12085277 0.84 CAMK1D (0.59) SYKAURKBKCNH2CAMK1DMAPK3
SCHEMBL12085437 0.84 CAMK1D (0.55) SYKAURKBKCNH2CAMK1DMAPK3
SCHEMBL12085290 0.82 SYK (0.54) SYKAURKBKCNH2ZAP70CAMK1D
SCHEMBL12085361 0.81 SYK (0.57) SYKAURKBKCNH2ZAP70MAPK3
SCHEMBL14670756 0.80 CAMK1D (0.63) SYKAURKBKCNH2CAMK1DMAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-31 — — US disclosed
US-8258144-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-09-04 — — US disclosed
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 — — US 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-20130029944-A1 INHIBITORS OF PROTEIN KINASES SYK, BTK, JAK2 SYK 1/4885L3MBTL1 3724/4885AURKB 595/4885
US-20090298823-A1 Inhibitors of protein kinases SYK, BTK, JAK2 SYK 1/4885L3MBTL1 3724/4885AURKB 595/4885

“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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