SCHEMBL3280668

SCHEMBL3280668

CC(=O)N(C)c1ccc(Nc2nc(Nc3ccc4nc[nH]c4c3)c3cc[nH]c3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 11/20 0.46
PTK2 Q05397 3/20 0.42
CDK4 P11802 2/20 0.42
SYK P43405 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
BRAF P15056 1/20 0.42
MAPK3 P27361 1/20 0.42
JAK3 P52333 1/20 0.41
BTK Q06187 1/20 0.41
TERT O14746 1/20 0.40

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
SCHEMBL3279927 0.83 ROCK2 (0.43) PTK2SYKJAK3BTK
SCHEMBL12085337 0.81 PTK2 (0.50) PTK2SYKBRAFJAK3BTK
SCHEMBL13406586 0.80 CDK1 (0.43) CDK1CDK4SYKMEN1NPC1
SCHEMBL4381772 0.79 PTK2 (0.44) PTK2JAK3BTK
SCHEMBL14666810 0.79 BRD4 (0.46) PTK2BRAFJAK3BTK
SCHEMBL3286398 0.78 SYK (0.49) CDK1PTK2SYKJAK3BTK
SCHEMBL1017841 0.78 BRD4 (0.47) CDK1PTK2SYKBRAFJAK3
SCHEMBL13387040 0.77 CDK1 (0.54) CDK1CDK4SYKMAPK3
SCHEMBL4380216 0.76 LRRK2 (0.51) PTK2SYKJAK3BTK
SCHEMBL12085362 0.76 TTBK1 (0.53) PTK2SYKRAB9AJAK3BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7705004-B2 Protein kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-04-27 US disclosed
US-7705004-B2 Protein kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-04-27 US disclosed
WO-2009026107-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 WO disclosed
US-20090054425-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 US disclosed
US-20090054425-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 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 (1 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-20090054425-A1 PROTEIN KINASE INHIBITORS SYK, JAK2, BTK CDK1 278/4885PTK2 196/4885CDK4 504/4885

“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.