SCHEMBL264663

SCHEMBL264663

Cc1cccc(-c2cnc(Nc3ccc(OC4CCNCC4)cc3)nc2N)c1C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
TYK2 P29597 1/20 0.42
JAK3 P52333 1/20 0.42
AXL P30530 7/20 0.40
TYRO3 Q06418 3/20 0.40
BTK Q06187 1/20 0.40
ROCK1 Q13464 1/20 0.39
SYK P43405 3/20 0.39
MERTK Q12866 1/20 0.38
WEE1 P30291 1/20 0.37
ACVR1 Q04771 2/20 0.37
DYRK1A Q13627 1/20 0.37
ACVR1B P36896 1/20 0.37
TGFBR1 P36897 1/20 0.37
KCNH2 Q12809 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
SCHEMBL265568 0.88 SOS1 (0.45) JAK2JAK1TYK2JAK3SYK
SCHEMBL14536378 0.85 ROCK1 (0.46) JAK2JAK1TYK2JAK3AXL
SCHEMBL266257 0.83 SYK (0.48) JAK2JAK1TYK2JAK3AXL
SCHEMBL270122 0.80 AXL (0.46) JAK2JAK1TYK2JAK3AXL
SCHEMBL277891 0.79 AXL (0.36) JAK2JAK1TYK2JAK3AXL
Hydrochloric Acid SCHEMBL266775 0.79 AXL (0.46) JAK2JAK1TYK2JAK3AXL
SCHEMBL265022 0.75 BRD4 (0.38) JAK2JAK1TYK2JAK3AXL
SCHEMBL265114 0.74 KDR (0.40) ROCK1DYRK1A
SCHEMBL270515 0.74 SYK (0.51) JAK2JAK1JAK3AXLTYRO3
SCHEMBL264636 0.73 SYK (0.65) JAK2TYK2JAK3AXLBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 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-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 JAK2 1/4885JAK1 4/4885TYK2 2/4885

“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.