SCHEMBL15769896

SCHEMBL15769896

COc1cnc(Nc2ccc(C3CC3)c(C#N)c2)nc1NC[C@@H]1CCCN2CCCC[C@H]12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.41
KDR P35968 1/20 0.41
LRRK2 Q5S007 4/20 0.40
PKMYT1 Q99640 3/20 0.39
PLK1 P53350 1/20 0.39
CDK4 P11802 2/20 0.38
CCND1 P24385 2/20 0.38
PRKCQ Q04759 3/20 0.38
DAPK3 O43293 1/20 0.38
STK17B O94768 1/20 0.38
DAPK1 P53355 1/20 0.38
STK17A Q9UEE5 1/20 0.38
TBK1 Q9UHD2 1/20 0.37
ULK1 O75385 1/20 0.37
ULK2 Q8IYT8 1/20 0.37
NUAK1 O60285 1/20 0.37
EGFR P00533 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
SCHEMBL15769152 0.91 PKMYT1 (0.42) CDK1KDRLRRK2PKMYT1PLK1
SCHEMBL15769975 0.90 PRKCQ (0.47) CDK1KDRLRRK2PRKCQDAPK3
SCHEMBL15769467 0.90 TNK2 (0.40) PRKCQSTK17AULK1ULK2
SCHEMBL15769286 0.88 PRKCQ (0.42) PRKCQ
SCHEMBL15769777 0.88 TNK2 (0.46) PKMYT1PRKCQ
SCHEMBL15769873 0.88 TNK2 (0.46) PKMYT1PRKCQ
SCHEMBL20752214 0.88 PRKCQ (0.38) CDK1KDRLRRK2CDK4CCND1
SCHEMBL15769863 0.88 PRKCQ (0.38) CDK1KDRLRRK2CDK4CCND1
SCHEMBL15769434 0.87 LRRK2 (0.42) LRRK2PLK1
SCHEMBL15770254 0.86 ABCG2 (0.44) CDK1KDRLRRK2PRKCQEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2928891-B1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2019-02-20 EP claimed
US-9062068-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2015-06-23 US claimed
US-20140163022-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2014-06-12 US claimed
EP-2928891-B1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2019-02-20 EP disclosed
EP-2928891-B1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2019-02-20 EP disclosed
US-9913843-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2018-03-13 US disclosed
US-9913843-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2018-03-13 US disclosed
US-9913843-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2018-03-13 US disclosed
US-20150306100-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2015-10-29 US disclosed
US-20150306100-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2015-10-29 US disclosed
US-20150306100-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2015-10-29 US disclosed
US-9062068-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-9062068-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-9062068-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-20140163022-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2014-06-12 US disclosed
US-20140163022-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2014-06-12 US disclosed
US-20140163022-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2014-06-12 US disclosed
WO-2014089112-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS, INC. (US) 2014-06-12 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-20140163022-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF PRKCH, PRKCA, PRKCB CDK1 389/4885KDR 3101/4885LRRK2 427/4885
US-20150306100-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF PRKCH, PRKCA, PRKCB CDK1 389/4885KDR 3101/4885LRRK2 427/4885

“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.