SCHEMBL31469377

SCHEMBL31469377

Cn1cc(B(O)O)c(-c2cscn2)n1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.35
▸ METAP2 P50579 1/20 0.34
▸ METAP1 P53582 1/20 0.34
▸ PDE10A Q9Y233 4/20 0.33
▸ ECE1 P42892 1/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ KDM4B O94953 1/20 0.33
▸ KDM5C P41229 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ FLT3 P36888 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ AURKB Q96GD4 1/20 0.32
▸ CSNK1D P48730 1/20 0.31
▸ CSNK1E P49674 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL31469393 0.78 TDP2 (0.38) TDP2METAP2METAP1PDE10AECE1
SCHEMBL31469325 0.71 KDM4E (0.41) TDP2METAP1KDM4AALDH1A1
SCHEMBL31469335 0.69 CSNK1D (0.48) FLT3SYKAURKBCSNK1DCSNK1E
SCHEMBL2047756 0.68 LMNA (0.39) PDE10AECE1
SCHEMBL19806539 0.67 TGFBR1 (0.52) METAP2PDE10A
SCHEMBL25321979 0.63 CSNK1D (0.64) AURKBCSNK1D
SCHEMBL953920 0.63 COMT (0.36) ALDH1A1
SCHEMBL7964249 0.62 TSHR (0.50) TDP2METAP2METAP1KDM4AKDM4B
SCHEMBL243089 0.62 — —
SCHEMBL13874035 0.61 JMJD6 (0.46) —

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
CN-122029158-A EGFR inhibitors 缆图药品公司 2026-05-12 — — CN disclosed
WO-2025080784-A1 EGFR INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2025-04-17 — — WO disclosed
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