SCHEMBL34464372

SCHEMBL34464372

c1cc(-c2cncnc2)c2ncnn2c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 2/20 0.42
▸ ADRA1D P25100 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MAP4K4 O95819 6/20 0.40
▸ ATR Q13535 1/20 0.39
▸ GLA P06280 1/20 0.38
▸ NCOA1 Q15788 1/20 0.37
▸ NCOA3 Q9Y6Q9 1/20 0.37
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ ATM Q13315 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ BMP4 P12644 1/20 0.34

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
SCHEMBL1811759 0.70 AXL (0.52) ALDH1A1HTTKDM4EMAP4K4GLA
SCHEMBL2032616 0.68 MAP4K4 (0.46) ALDH1A1HTTKDM4EMAP4K4GLA
SCHEMBL9824111 0.68 MAP4K4 (0.50) ALDH1A1HTTKDM4EMAP4K4GLA
SCHEMBL2661228 0.68 ALDH1A1 (0.49) ALDH1A1HTTKDM4EMAP4K4ATR
SCHEMBL398829 0.68 MAP4K4 (0.60) ALDH1A1HTTKDM4EMAP4K4ATR
SCHEMBL5234266 0.68 MAP4K4 (0.46) ALDH1A1HTTKDM4EMAP4K4ATR
SCHEMBL19942301 0.68 MAP4K4 (0.46) ALDH1A1HTTKDM4EMAP4K4ATR
SCHEMBL21323985 0.66 CDK8 (0.38) ALDH1A1HTTKDM4EMAP4K4GLA
SCHEMBL15550843 0.66 MAP4K4 (0.37) ALDH1A1HTTKDM4EMAP4K4GLA
SCHEMBL11031739 0.66 ALDH1A3 (0.46) ADRA1AADRA1DALDH1A1KDM4EJAK2

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
EP-3870583-B1 SUBSTITUTED INDOLE AND INDAZOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2026-04-22 — — EP claimed
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