SCHEMBL8994679

SCHEMBL8994679

CC(C)[C@@H](C)Nc1cccc(C2CNc3ncc(Cl)cc32)n1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.32
FLT3 P36888 3/20 0.31
MAPK14 Q16539 1/20 0.31
NRAS P01111 2/20 0.31
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL8989594 0.84 ESR1 (0.36) FLT3MAPK14
SCHEMBL8990611 0.84 NTRK1 (0.40) MAPK14
SCHEMBL8988092 0.78 TSHR (0.38)
SCHEMBL8994914 0.73 AURKA (0.35) FLT3IRAK4
SCHEMBL8987971 0.69 EIF2AK4 (0.40)
SCHEMBL10067942 0.69 IDH1 (0.31)
SCHEMBL10067701 0.67 HTRA1 (0.33) IRAK4
SCHEMBL13932795 0.66 PSEN1 (0.39)
SCHEMBL8941005 0.66 JAK2 (0.50)
SCHEMBL10067629 0.65 TRPV3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188281-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2009-07-09 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-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases JAK3, JAK2, JAK1 NR4A2 3916/4885FLT3 310/4885MAPK14 422/4885

“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.