SCHEMBL16655745

SCHEMBL16655745

Nc1ncnc2c1c(-c1ccc(O)cc1)cn2C1CCc2ccccc2C1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 15/20 0.69
EGFR P00533 11/20 0.69
ABL1 P00519 9/20 0.69
ABL2 P42684 9/20 0.69
RIPK2 O43353 2/20 0.67
LCK P06239 3/20 0.56
KDR P35968 3/20 0.56
LYN P07948 2/20 0.56
JAK2 O60674 1/20 0.56
NTRK1 P04629 1/20 0.56
INSR P06213 1/20 0.56
NPM1 P06748 1/20 0.56
CSF1R P07333 1/20 0.56
RET P07949 1/20 0.56
IGF1R P08069 1/20 0.56
MET P08581 1/20 0.56
ROS1 P08922 1/20 0.56
PDGFRB P09619 1/20 0.56
KIT P10721 1/20 0.56
BCR P11274 1/20 0.56

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
SCHEMBL16655524 0.92 SRC (0.73) SRCEGFRABL1ABL2RIPK2
SCHEMBL16655972 0.86 PIK3CD (0.61) SRCEGFRABL1ABL2RIPK2
SCHEMBL16654722 0.84 PIK3CD (0.61) SRCEGFRABL1ABL2RIPK2
SCHEMBL16654211 0.80 ATR (0.54) SRCEGFRABL1ABL2RIPK2
SCHEMBL7020106 0.79 SRC (0.87) SRCEGFRABL1ABL2RIPK2
SCHEMBL6867601 0.79 SRC (0.80) SRCEGFRABL1ABL2RIPK2
SCHEMBL16655615 0.79 ATR (0.76) SRCEGFRABL1KDRMTOR
SCHEMBL31060265 0.78 PIK3CD (0.66) SRCEGFRABL1ABL2RIPK2
SCHEMBL16655471 0.78 PIK3CD (0.66) SRCEGFRABL1ABL2RIPK2
SCHEMBL16655704 0.78 PIK3CD (0.66) SRCEGFRABL1ABL2RIPK2

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-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 US claimed
EP-3057970-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Medivation Technologies, Inc. (US) 2016-08-24 EP claimed
WO-2015058084-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-23 WO claimed
WO-2015058084-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-23 WO 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-20210317140-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB SRC 92/4885EGFR 828/4885ABL1 62/4885

“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.