SCHEMBL16655515

SCHEMBL16655515

COc1cc(F)cc(-c2cn(C3Cc4ccccc4C3)c3ncnc(N)c23)c1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.68
BTK Q06187 3/20 0.68
SRC P12931 9/20 0.60
ABL1 P00519 8/20 0.60
EGFR P00533 8/20 0.60
ABL2 P42684 8/20 0.60
RIPK2 O43353 3/20 0.54
LCK P06239 2/20 0.52
KDR P35968 2/20 0.52
TEK Q02763 2/20 0.52
FGFR1 P11362 1/20 0.51
FGFR4 P22455 1/20 0.51

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
SCHEMBL16655471 0.85 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR
SCHEMBL31060265 0.85 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655606 0.84 TEK (0.53) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655530 0.81 PIK3CD (1.00) PIK3CDBTKSRCABL1EGFR
SCHEMBL16654148 0.78 PIK3CD (0.67) PIK3CDBTKSRCABL1EGFR
SCHEMBL16654459 0.78 SRC (0.51) PIK3CDBTKSRCABL1EGFR
Hydrochloric Acid SCHEMBL23908623 0.78 PIK3CD (0.66) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655325 0.77 PIK3CD (1.00) PIK3CDBTK
SCHEMBL16655504 0.77 PIK3CD (0.55) PIK3CDBTKSRCABL1EGFR
SCHEMBL16655524 0.76 SRC (0.73) BTKSRCABL1EGFRABL2

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.