SCHEMBL8969640

SCHEMBL8969640

Cc1ccc(CC(=O)N2CCCN(c3cccc(C(=O)c4cccnc4N)n3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 18/20 0.66
PRKCA P17252 3/20 0.61
PRKCD Q05655 3/20 0.61
KDM4E B2RXH2 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL8969827 0.92 PRKCQ (0.67) PRKCQPRKCAPRKCDKDM4ESMN1; SMN2
SCHEMBL8969861 0.91 PRKCQ (0.64) PRKCQPRKCAPRKCDKDM4ESMN1; SMN2
SCHEMBL8969670 0.87 PRKCQ (0.73) PRKCQPRKCAPRKCD
SCHEMBL9007648 0.87 PRKCQ (0.62) PRKCQPRKCAPRKCDKDM4EHPGD
SCHEMBL8969853 0.86 KDM4E (0.49) PRKCQPRKCAPRKCDKDM4ESMN1; SMN2
SCHEMBL13857179 0.85 PRKCQ (0.54) PRKCQPRKCAPRKCDKDM4ESMN1; SMN2
SCHEMBL8969714 0.85 PRKCQ (0.69) PRKCQPRKCAPRKCD
SCHEMBL8969777 0.85 PRKCQ (0.69) PRKCQPRKCAPRKCD
SCHEMBL8969766 0.85 PRKCQ (0.69) PRKCQPRKCAPRKCDSMN1; SMN2HPGD
SCHEMBL8969646 0.84 PRKCQ (0.66) PRKCQPRKCAPRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221334-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-07 US disclosed
US-8741931-B2 Kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED 2014-06-03 US disclosed
US-20120214799-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-08-23 US disclosed
US-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-20090124602-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-05-14 US disclosed
US-20090124602-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-05-14 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 (3 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-20140221334-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 PRKCQ 38/4885PRKCA 25/4885PRKCD 120/4885
US-20120214799-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 PRKCQ 38/4885PRKCA 25/4885PRKCD 120/4885
US-20090124602-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 PRKCQ 38/4885PRKCA 25/4885PRKCD 120/4885

“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.