SCHEMBL270572

SCHEMBL270572

CC(C)(C)Nc1nccc(Nc2ccc(O)cc2)n1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 5/20 0.71
MAPK1 P28482 4/20 0.50
NPC1 O15118 3/20 0.50
MAPT P10636 3/20 0.50
RAB9A P51151 3/20 0.50
MEN1 O00255 2/20 0.50
LMNA P02545 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 1/20 0.50
ALOX12 P18054 1/20 0.50
PLK1 P53350 9/20 0.49
CHEK1 O14757 2/20 0.49
PDPK1 O15530 2/20 0.49
CHEK2 O96017 2/20 0.49
PIM1 P11309 2/20 0.49
FGFR3 P22607 2/20 0.49
MARK3 P27448 2/20 0.49
RPS6KA3 P51812 2/20 0.49
PRKCD Q05655 2/20 0.49
MARK2 Q7KZI7 2/20 0.49

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
SCHEMBL1321961 0.84 AURKA (1.00) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL270194 0.83 SYK (0.74) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL17915955 0.83 AURKA (0.78) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL270442 0.82 MAPT (0.76) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL23244457 0.80 PLK1 (0.43) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL307468 0.79 AURKA (0.71) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL5384269 0.78 AURKA (0.87) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL270162 0.72 EGFR (0.78) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL6967800 0.72 IGF1R (0.71) AURKAMAPK1NPC1MAPTRAB9A
SCHEMBL7767541 0.71 AURKA (0.73) AURKAMAPK1NPC1MAPTRAB9A

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 11 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
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-7825246-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2010-11-02 US disclosed
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 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 (6 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-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, LTK AURKA 745/4885MAPK1 356/4885NPC1 3924/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 AURKA 75/4885MAPK1 298/4885NPC1 4069/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 AURKA 75/4885MAPK1 298/4885NPC1 4069/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 AURKA 75/4885MAPK1 298/4885NPC1 4069/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 AURKA 75/4885MAPK1 298/4885NPC1 4069/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B AURKA 3934/4885MAPK1 2410/4885NPC1 3427/4885

“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.