SCHEMBL12085349

SCHEMBL12085349

Cc1cc(C)cc(Nc2nc(N3CCCC(C(N)=O)C3)ncc2C(N)=O)c1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CAMK1D Q8IU85 20/20 0.66
▸ PIP5K1C O60331 1/20 0.66
▸ CYP2C9 P11712 1/20 0.66
▸ CYP2C19 P33261 1/20 0.66
▸ RIPK4 P57078 1/20 0.66
▸ KCNH2 Q12809 1/20 0.66
▸ MAP2K5 Q13163 1/20 0.66
▸ CAMK1 Q14012 1/20 0.66
▸ MAP3K11 Q16584 1/20 0.66
▸ PNCK Q6P2M8 1/20 0.66
▸ CAMK1G Q96NX5 1/20 0.66

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
SCHEMBL12085360 0.88 CAMK1D (0.57) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
SCHEMBL12085312 0.84 CAMK1D (0.62) CAMK1DRIPK4KCNH2MAP2K5MAP3K11
SCHEMBL12085395 0.82 CAMK1D (0.54) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
SCHEMBL24735838 0.80 CAMK1D (1.00) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
SCHEMBL28490450 0.80 CAMK1D (1.00) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
Hydrochloric Acid SCHEMBL23113343 0.79 CAMK1D (0.98) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
Hydrochloric Acid SCHEMBL23113341 0.79 CAMK1D (0.98) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
SCHEMBL23113453 0.79 CAMK1D (0.77) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4
SCHEMBL14670756 0.79 CAMK1D (0.63) CAMK1DRIPK4KCNH2MAP2K5MAP3K11
SCHEMBL23113375 0.78 CAMK1D (1.00) CAMK1DPIP5K1CCYP2C9CYP2C19RIPK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139581-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2015-09-22 — — US disclosed
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 CAMK1D 778/4885PIP5K1C 115/4885CYP2C9 461/4885
US-20090298823-A1 Inhibitors of protein kinases SYK, BTK, JAK2 CAMK1D 778/4885PIP5K1C 115/4885CYP2C9 461/4885

“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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