SCHEMBL19508034

SCHEMBL19508034

Cc1ncc2c(n1)N(C)C(=O)N(C)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 10/20 0.40
HSP90AA1 P07900 5/20 0.33
TNK2 Q07912 2/20 0.33
MAP4K2 Q12851 2/20 0.33
EGFR P00533 2/20 0.33
FGFR1 P11362 2/20 0.33
ABL1 P00519 1/20 0.33
LCK P06239 1/20 0.33
FES P07332 1/20 0.33
RET P07949 1/20 0.33
PDGFRB P09619 1/20 0.33
KIT P10721 1/20 0.33
SRC P12931 1/20 0.33
PDGFRA P16234 1/20 0.33
FLT1 P17948 1/20 0.33
FGFR3 P22607 1/20 0.33
EPHA3 P29320 1/20 0.33
KDR P35968 1/20 0.33
BMX P51813 1/20 0.33
EPHB4 P54760 1/20 0.33

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
SCHEMBL6619181 0.78 FGFR4 (0.37) FGFR4EGFRFGFR1PKM
SCHEMBL17813504 0.76 CYP11B2 (0.39) HSP90AA1HSP90AB1
SCHEMBL30853317 0.75 FGFR4 (0.44) FGFR4
SCHEMBL17813505 0.73 HSP90AA1 (0.31) HSP90AA1
SCHEMBL17813511 0.73 IDH1 (0.40) HSP90AA1
SCHEMBL23653119 0.72 FGFR4 (0.64) FGFR4FGFR1FGFR3KDR
SCHEMBL25462212 0.71 STK4 (0.40)
SCHEMBL25462583 0.71 STK4 (0.51)
SCHEMBL25462291 0.70 HPGD (0.41) HSP90AA1
SCHEMBL19508032 0.70 FGFR4 (0.37) FGFR4TNK2MAP4K2FGFR1FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023083297-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2023-05-19 WO disclosed
US-20170305918-A1 DUAL-WARHEAD COVALENT INHIBITORS OF FGFR-4 NEWAVE PHARMACEUTICAL INC. 2017-10-26 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-20170305918-A1 DUAL-WARHEAD COVALENT INHIBITORS OF FGFR-4 FGFR4, FGFR2, FGFR3 FGFR4 1/4885HSP90AA1 2347/4885TNK2 668/4885

“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.