SCHEMBL15769433

SCHEMBL15769433

COc1cnc(Nc2cc(C#N)c(C3CC3)cc2F)nc1N(C)[C@H]1CCCN2CCCC[C@H]12

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 14/20 0.38
PLK1 P53350 3/20 0.37
ALK Q9UM73 1/20 0.35
MAPT P10636 1/20 0.34
NUAK1 O60285 1/20 0.34

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
SCHEMBL15769392 0.91 LRRK2 (0.32) LRRK2PLK1ALKNUAK1
SCHEMBL15770073 0.90 LCK (0.35) LRRK2PLK1ALK
SCHEMBL15769944 0.89 LRRK2 (0.31) LRRK2PLK1
SCHEMBL15769708 0.89 ALK (0.35) LRRK2ALK
SCHEMBL15769752 0.88 LRRK2 (0.41) LRRK2PLK1
SCHEMBL15769905 0.87 CDK1 (0.40) LRRK2PLK1NUAK1
SCHEMBL15770221 0.82 PLK1 (0.34) LRRK2PLK1ALK
SCHEMBL15769445 0.82 JAK3 (0.38) PLK1
SCHEMBL15769776 0.82 CSNK2A2 (0.34) PLK1
SCHEMBL15769434 0.81 LRRK2 (0.42) LRRK2PLK1ALK

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-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
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-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

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 LRRK2 427/4885PLK1 143/4885ALK 1486/4885
US-20150306100-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF PRKCH, PRKCA, PRKCB LRRK2 427/4885PLK1 143/4885ALK 1486/4885

“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.