SCHEMBL13719359

SCHEMBL13719359

Cc1cc(N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c2[nH]c(=O)n(C)c2n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.47
BTK Q06187 3/20 0.45
JAK3 P52333 2/20 0.45
DPP4 P27487 7/20 0.45
AURKA O14965 3/20 0.45
PDPK1 O15530 3/20 0.45
AURKB Q96GD4 3/20 0.45
PIM1 P11309 1/20 0.41
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
PDE10A Q9Y233 1/20 0.41
SYK P43405 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
EGFR P00533 1/20 0.40
LCK P06239 1/20 0.40

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
SCHEMBL12518769 0.95 PIM1 (0.46) MAP4K4BTKDPP4AURKAPDPK1
SCHEMBL12517290 0.91 BTK (0.49) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL13822690 0.91 BTK (0.49) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL13822697 0.89 MAP4K4 (0.45) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL13719171 0.89 MAP4K4 (0.45) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL13719169 0.89 MAP4K4 (0.45) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL15623620 0.89 BTK (0.46) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL12518928 0.89 MAP4K4 (0.45) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL12518782 0.89 JAK3 (0.46) MAP4K4BTKJAK3DPP4AURKA
SCHEMBL12517519 0.85 MAP4K4 (0.47) MAP4K4BTKJAK3DPP4AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2524917-B1 FUSED PYRIDINE DERIVATIVES SIHUAN PHARMACEUTICAL HOLDINGS GROUP LTD (CN) 2018-06-27 EP disclosed
US-8680089-B2 Fused pyridine derivatives Xuanzhu Pharma Co., Ltd. (CN) 2014-03-25 US disclosed
US-8680089-B2 Fused pyridine derivatives Xuanzhu Pharma Co., Ltd. (CN) 2014-03-25 US disclosed
EP-2524917-A1 FUSED PYRIDINE DERIVATIVES Xuanzhu Pharmaco., Ltd. (CN) 2012-11-21 EP disclosed
US-20120289497-A1 FUSED PYRIDINE DERIVATIVES Xuanzhu Pharma Co., Ltd. (CN) 2012-11-15 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-20120289497-A1 FUSED PYRIDINE DERIVATIVES GPR119, INSR, IAPP MAP4K4 1184/4885BTK 1042/4885JAK3 566/4885

“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.