SCHEMBL16655811

SCHEMBL16655811

C=CC(=O)N1CC(n2nc(-c3cc4cc(F)c(Oc5ccccc5)cc4[nH]3)c3c(N)ncnc32)Cc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.48
BTK Q06187 19/20 0.48
BLK P51451 3/20 0.47
BMX P51813 4/20 0.46
TEC P42680 3/20 0.46
TXK P42681 2/20 0.46
LYN P07948 2/20 0.46
FGFR2 P21802 2/20 0.46
ITK Q08881 2/20 0.46
HCK P08631 2/20 0.46
SRC P12931 2/20 0.46
RIPK2 O43353 1/20 0.46
NR1I2 O75469 1/20 0.46
SLC22A3 O75751 1/20 0.46
LATS1 O95835 1/20 0.46
NUDT14 O95848 1/20 0.46
ABL1 P00519 1/20 0.46
ERBB2 P04626 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46

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
SCHEMBL16655271 0.97 EGFR (0.48) EGFRBTKBLKBMXTEC
SCHEMBL16655734 0.91 RET (0.43) EGFRBTKRETKDR
SCHEMBL23917225 0.90 EGFR (0.44) EGFRBTKBLKBMXTEC
SCHEMBL16655803 0.89 PIK3CD (0.49) EGFRBTKFGFR2RETKDR
SCHEMBL16655543 0.89 RET (0.43) EGFRBTKRETKDR
SCHEMBL16655736 0.88 PIK3CD (0.49) EGFRBTKFGFR2RETKDR
SCHEMBL16655372 0.86 RET (0.59) EGFRFGFR2ITKSRCABL1
SCHEMBL16655696 0.85 RET (0.54) BTKLYNNUDT14LCKRET
SCHEMBL16655897 0.83 RET (0.54) BTKLYNNUDT14LCKRET
SCHEMBL16656024 0.83 BTK (0.44) EGFRBTKBLKBMXTEC

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-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

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 EGFR 828/4885BTK 1/4885BLK 112/4885

“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.