SCHEMBL271050

SCHEMBL271050

Cc1cnc(Nc2ccc(OC3CCCCC3)cc2)nc1Nc1cccc(C)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 4/20 0.46
AXL P30530 6/20 0.46
CDK2 P24941 3/20 0.44
CCNA2 P20248 1/20 0.44
SYK P43405 2/20 0.43
BRD4 O60885 6/20 0.43
CDK4 P11802 1/20 0.43
EGFR P00533 3/20 0.42
BTK Q06187 2/20 0.42
JAK1 P23458 2/20 0.42
HDAC1 Q13547 2/20 0.42
JAK2 O60674 3/20 0.41
JAK3 P52333 3/20 0.41
RET P07949 2/20 0.41
TYK2 P29597 2/20 0.41
FLT3 P36888 2/20 0.41
ITK Q08881 2/20 0.41
CDC7 O00311 1/20 0.41
PLK4 O00444 1/20 0.41
CHEK1 O14757 1/20 0.41

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
SCHEMBL270122 0.90 AXL (0.46) AURKAAXLCDK2SYKBRD4
Hydrochloric Acid SCHEMBL266775 0.89 AXL (0.46) AURKAAXLCDK2SYKBRD4
SCHEMBL271260 0.88 SCN9A (0.52) AURKAAXLCDK2SYKBRD4
SCHEMBL12109393 0.85 AXL (0.44) AURKAAXLCDK2SYKBRD4
SCHEMBL12109284 0.85 AXL (0.46) AURKAAXLSYKROCK2WEE1
SCHEMBL271520 0.84 AURKA (0.51) AURKACDK2SYKBRD4CDK4
SCHEMBL271021 0.83 SYK (0.68) AURKAAXLCDK2SYKBRD4
SCHEMBL271306 0.81 JAK2 (0.56) AURKASYKBRD4JAK1HDAC1
SCHEMBL270995 0.81 BRD4 (0.61) AURKAAXLCDK2SYKBRD4
SCHEMBL270949 0.80 BRD4 (0.49) AURKAAXLSYKBRD4STK17A

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 4 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-20110269721-A1 METHODS OF TREATING THALASSEMIA TARGEGEN, INC. (US) 2011-11-03 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 (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-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 AURKA 75/4885AXL 267/4885CDK2 14/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B AURKA 3934/4885AXL 2199/4885CDK2 1200/4885

“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.