SCHEMBL21565626

SCHEMBL21565626

CC(C)c1cncnc1-c1ccc2cn[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.51
SRC P12931 3/20 0.51
KDR P35968 3/20 0.51
PIK3CD O00329 2/20 0.51
EGFR P00533 2/20 0.51
HCK P08631 2/20 0.51
PIK3CA P42336 2/20 0.51
PIK3CB P42338 2/20 0.51
MTOR P42345 2/20 0.51
PIK3CG P48736 2/20 0.51
EPHB4 P54760 2/20 0.51
PRKDC P78527 2/20 0.51
FGFR1 P11362 11/20 0.47
FGFR2 P21802 6/20 0.46
FGFR3 P22607 2/20 0.46
TRPA1 O75762 1/20 0.45
TGFBR1 P36897 3/20 0.44
BRAF P15056 1/20 0.43
MAPK1 P28482 2/20 0.42
PLK4 O00444 1/20 0.42

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
SCHEMBL20385993 0.85 FGFR1 (0.55) ABL1SRCKDRPIK3CDEGFR
SCHEMBL21565627 0.77 ABL1 (0.50) ABL1SRCKDRPIK3CDEGFR
SCHEMBL20386115 0.73 FGFR1 (0.51) ABL1SRCKDRPIK3CDEGFR
SCHEMBL21565697 0.73 KDM5B (0.37) ABL1SRCKDRPIK3CDEGFR
SCHEMBL21565698 0.71 MAPK1 (0.48) ABL1SRCKDRPIK3CDEGFR
SCHEMBL1318366 0.70 FGFR1 (0.55) ABL1SRCKDRPIK3CDEGFR
SCHEMBL12277412 0.70 ATM (0.42) MAPK1JAK2PIM1MAPK9CLK4
SCHEMBL21565692 0.69 CLK4 (0.48) ABL1KDRFGFR1MAPK1CHEK1
SCHEMBL4046369 0.69 PIK3CD (0.53) ABL1SRCKDRPIK3CDEGFR
SCHEMBL28200925 0.69 FGFR1 (0.54) ABL1SRCKDRPIK3CDEGFR

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
US-20210015793-A1 COMPOUNDS FOR TREATING CNS- AND NEURODEGENERATIVE DISEASES ETH ZURICH (CH) 2021-01-21 US disclosed
US-20190343802-A1 CELL-PROTECTIVE COMPOUNDS AND THEIR USE ETH Zürich (CH) 2019-11-14 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 (2 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-20190343802-A1 CELL-PROTECTIVE COMPOUNDS AND THEIR USE SRPK2, SRSF2, SRPK1 ABL1 3917/4885SRC 664/4885KDR 1417/4885
US-20210015793-A1 COMPOUNDS FOR TREATING CNS- AND NEURODEGENERATIVE DISEASES PPT1, SPTLC1, LPCAT1 ABL1 4767/4885SRC 4675/4885KDR 4844/4885

“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.