SCHEMBL5015392

SCHEMBL5015392

NC(=O)C(c1ccccc1)c1ncc2cn[nH]c2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.39
CTSD P07339 1/20 0.38
DCAF1 Q9Y4B6 1/20 0.37
MAPK1 P28482 2/20 0.37
ROCK1 Q13464 3/20 0.36
FLT3 P36888 2/20 0.36
PLK4 O00444 1/20 0.36
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
MAP4K4 O95819 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
FGFR1 P11362 1/20 0.36
PDGFRA P16234 1/20 0.36
LTK P29376 1/20 0.36
KDR P35968 1/20 0.36
MAP2K2 P36507 1/20 0.36
CSNK1A1 P48729 1/20 0.36
PRKX P51817 1/20 0.36

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
SCHEMBL5027404 0.89 MAPK1 (0.38) CTSDMAPK1ROCK1FLT3HDAC3
SCHEMBL5015388 0.78 ALDH1A1 (0.35) CTSDHDAC3HDAC4HDAC1HDAC7
SCHEMBL13731148 0.75 CTSD (0.38) CTSDHDAC3HDAC4HDAC1HDAC7
SCHEMBL2492017 0.69 CTSD (0.43) CTSDHDAC3HDAC4HDAC1HDAC7
SCHEMBL29270208 0.69 CTSD (0.43) CTSDHDAC3HDAC4HDAC1HDAC7
SCHEMBL741751 0.69 MEN1 (0.58) CTSDMAPK1HDAC3HDAC4HDAC1
SCHEMBL5172651 0.69 AURKA (0.46) ROCK1AURKAMAP4K4ROCK2MEN1
Hydrochloric Acid SCHEMBL8550499 0.67 MEN1 (0.56) CTSDMAPK1HDAC3HDAC4HDAC1
SCHEMBL23751109 0.67 KMT2A (0.56) CTSDHDAC3HDAC4HDAC1HDAC7
SCHEMBL9326757 0.67 MEN1 (0.43) CTSDROCK1HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234262-A1 PYRAZOLOPYRIMIDINE ANALOGS AND THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS WYETH (US) 2008-09-25 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-20080234262-A1 PYRAZOLOPYRIMIDINE ANALOGS AND THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS MTOR, PIK3CA, PDPK1 SYK 839/4885CTSD 3949/4885DCAF1 2087/4885

“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.