SCHEMBL10189752

SCHEMBL10189752

Cc1cc(-c2nn[nH]c2-c2ccc3c(c2)OCC3)cc(C)c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 2/20 0.36
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
PRKAG3 Q9UGI9 1/20 0.33
PRKAG2 Q9UGJ0 1/20 0.33
PRKAB1 Q9Y478 1/20 0.33
CD274 Q9NZQ7 2/20 0.32
DYRK1A Q13627 1/20 0.32
EGFR P00533 1/20 0.31
PDGFRA P16234 1/20 0.31
KDR P35968 1/20 0.31
GRIA2 P42262 1/20 0.31
ALOX5 P09917 1/20 0.30
KIT P10721 1/20 0.30
PDE2A O00408 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRNB2 P17787 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
SCHEMBL10189778 0.88 BRD4 (0.32) OGAPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL414234 0.81 KDM4E (0.41) KDR
SCHEMBL408515 0.78 ALDH1A1 (0.44) KIT
SCHEMBL10189724 0.77 KDM4E (0.42) CD274
SCHEMBL10189753 0.72 GSK3B (0.41) DYRK1AKDR
SCHEMBL411907 0.70 GSK3A (0.43) DYRK1A
SCHEMBL410978 0.68 KDM4E (0.50) KIT
SCHEMBL411631 0.68 TGFBR1 (0.46) DYRK1A
SCHEMBL10189751 0.68 TSHR (0.30)
SCHEMBL10189779 0.68 MAPK1 (0.34) KDR

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-9175022-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2015-11-03 US disclosed
US-8501790-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2013-08-06 US disclosed
US-20120022118-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2012-01-26 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-20120022118-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS RB1, MKI67, MAPRE1 OGA 4543/4885PRKAB2 2502/4885PRKAG1 2066/4885

“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.