SCHEMBL22360680

SCHEMBL22360680

Cn1cc(-c2ccnc(NCCC#N)n2)c(-c2cnc3[nH]ccc3c2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.45
PIK3CD O00329 2/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CB P42338 2/20 0.39
PIK3CG P48736 2/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
HCK P08631 1/20 0.39
SRC P12931 1/20 0.39
KDR P35968 1/20 0.39
MTOR P42345 1/20 0.39
EPHB4 P54760 1/20 0.39
PRKDC P78527 1/20 0.39
RIPK1 Q13546 1/20 0.38
NUDT1 P36639 1/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
STAT3 P40763 1/20 0.37
JAK3 P52333 1/20 0.37

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
SCHEMBL2639673 0.90 BRAF (0.54) BRAFPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2640166 0.89 BRAF (0.41) BRAFPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL22473738 0.86 BRAF (0.44) BRAFPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2640189 0.86 BRAF (0.40) BRAFPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2639988 0.85 BRAF (0.44) BRAFRIPK1NUDT1
SCHEMBL29352906 0.85 BRAF (0.44) BRAFRIPK1NUDT1
SCHEMBL2639880 0.83 ACVR1 (0.42) BRAFPIK3CDPIK3CAMTORMKNK1
SCHEMBL13939855 0.83 ACVR1 (0.39) BRAFPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2640207 0.83 BRAF (0.56) BRAFPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2639780 0.81 BRAF (0.60) BRAFPIK3CDPIK3CAPIK3CGEGFR

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-10787443-B2 RAF-degrading conjugate compounds ZAMBONI CHEM SOLUTIONS INC. (CA) 2020-09-29 US disclosed
WO-2020168172-A1 CONJUGATE COMPOUNDS FOR THE DEGRADATION OF RAF ZAMBONI CHEM SOLUTIONS INC. (CA) 2020-08-20 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-10787443-B2 RAF-degrading conjugate compounds BRAF, RAF1, ARAF BRAF 1/4885PIK3CD 865/4885PIK3CA 328/4885

“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.