SCHEMBL12463243

SCHEMBL12463243

Cc1nc(F)nc2[nH]ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
PRKCI P41743 3/20 0.38
DYRK1A Q13627 2/20 0.38
AXL P30530 2/20 0.38
TGFBR1 P36897 6/20 0.36
TGFBR2 P37173 4/20 0.36
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
PAK4 O96013 1/20 0.36
NTRK1 P04629 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
IGF1R P08069 1/20 0.36
MET P08581 1/20 0.36
PIM1 P11309 1/20 0.36
FGFR1 P11362 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
SCHEMBL5134352 0.79 ADORA2A (0.44) ADORA2AADORA1PRKCIDYRK1AAXL
Ammonia Solution, Strong SCHEMBL18806383 0.78 ADORA2A (0.43) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL2147990 0.76 PRKCI (0.41) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL1689372 0.76 DYRK1A (0.46) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL20748444 0.76 ADORA2A (0.42) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL9912500 0.76 PIK3CA (0.50) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL12574854 0.76 PRKCI (0.46) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL12395339 0.76 JAK3 (0.36) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL23170164 0.74 ADORA2A (0.41) ADORA2AADORA1PRKCIDYRK1AAXL
SCHEMBL14029857 0.73 ADORA2A (0.43) ADORA2AADORA1PRKCIDYRK1AAXL

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-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-07-07 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-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS JAK3, JAK2, JAK1 ADORA2A 2515/4885ADORA1 2238/4885PRKCI 419/4885

“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.