SCHEMBL16655504

SCHEMBL16655504

Nc1ncnc2c1c(-c1cc(O)c(F)c(Cl)c1)cn2C1Cc2ccccc2C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.55
BTK Q06187 3/20 0.55
SRC P12931 8/20 0.52
ABL1 P00519 9/20 0.51
EGFR P00533 8/20 0.51
ABL2 P42684 8/20 0.51
KDR P35968 4/20 0.50
RET P07949 3/20 0.50
KIF5B P33176 3/20 0.50
LCK P06239 3/20 0.50
JAK2 O60674 2/20 0.50
NTRK1 P04629 2/20 0.50
INSR P06213 2/20 0.50
NPM1 P06748 2/20 0.50
CSF1R P07333 2/20 0.50
LYN P07948 2/20 0.50
IGF1R P08069 2/20 0.50
MET P08581 2/20 0.50
PDGFRB P09619 2/20 0.50
KIT P10721 2/20 0.50

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
SCHEMBL16654148 0.90 PIK3CD (0.67) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655527 0.90 PIK3CD (0.55) PIK3CDBTKSRCABL1EGFR
Hydrochloric Acid SCHEMBL23908623 0.89 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655704 0.87 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR
SCHEMBL16654294 0.86 PIK3CD (0.52) PIK3CDBTKSRCABL1EGFR
SCHEMBL16654718 0.86 PIK3CD (0.52) PIK3CDBTKSRCABL1EGFR
SCHEMBL16654722 0.84 PIK3CD (0.61) PIK3CDBTKSRCABL1EGFR
SCHEMBL23917219 0.84 PIK3CD (0.50) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655471 0.83 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR
SCHEMBL31060265 0.83 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR

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 8 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
US-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 US disclosed
US-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 US disclosed
EP-3057970-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Medivation Technologies, Inc. (US) 2016-08-24 EP disclosed
WO-2015058084-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-23 WO disclosed
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 PIK3CD 2/4885BTK 1/4885SRC 92/4885

“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.