SCHEMBL9911259

SCHEMBL9911259

CNc1cc(OC)ccc1Nc1nc(Nc2ccccc2C)ncc1Cl

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.65
CCNA2 P20248 8/20 0.60
CDK2 P24941 8/20 0.60
CCNK O75909 5/20 0.60
CDK9 P50750 5/20 0.60
CCND3 P30281 4/20 0.56
CDK6 Q00534 4/20 0.56
INSR P06213 3/20 0.51
ALK Q9UM73 3/20 0.51
IGF1R P08069 2/20 0.51
MAPK9 P45984 1/20 0.51
MAPK10 P53779 1/20 0.51
MAPK3 P27361 3/20 0.50
PTK2 Q05397 1/20 0.49
ULK1 O75385 1/20 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
SCHEMBL9911261 0.92 LRRK2 (0.53) LRRK2CCNA2CDK2CCNKCDK9
SCHEMBL9911260 0.89 LRRK2 (0.71) LRRK2CDK9INSRALKIGF1R
SCHEMBL9911263 0.89 LRRK2 (0.50) LRRK2CCNA2CDK2CCNKCDK9
SCHEMBL9911257 0.88 LRRK2 (0.55) LRRK2CCNA2CDK2CCNKCDK9
SCHEMBL9912357 0.87 ROS1 (0.59) LRRK2CCNA2CDK2CCNKCDK9
Hydrochloric Acid SCHEMBL1706865 0.86 ROS1 (0.59) LRRK2CCNA2CDK2CCNKCDK9
SCHEMBL9911264 0.85 LRRK2 (0.50) LRRK2CCNA2CDK2CCNKCDK9
SCHEMBL9911266 0.84 LRRK2 (0.56) LRRK2INSRALKIGF1RMAPK3
SCHEMBL9911265 0.84 LRRK2 (0.49) LRRK2CDK9INSRALKIGF1R
SCHEMBL9911258 0.82 MAPK3 (0.49) LRRK2CCNA2CDK2CCNKCDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 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-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS ZAP70, LCK, DPY30 LRRK2 3072/4885CCNA2 2211/4885CDK2 572/4885

“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.