SCHEMBL23991552

SCHEMBL23991552

CC(=O)CN(C)c1nc(-c2ccccn2)nc2sc(C)c(C)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.46
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ALPL P05186 1/20 0.41
▸ METAP2 P50579 1/20 0.40
▸ METAP1 P53582 1/20 0.40
▸ HSD17B10 Q99714 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ADORA2A P29274 2/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.37
▸ LMNA P02545 3/20 0.37
▸ HTT P42858 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ IKBKB O14920 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
SCHEMBL23975886 0.92 KDM4E (0.48) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL23976260 0.91 KDM4E (0.46) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL23975855 0.88 ALDH1A1 (0.44) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL23975881 0.86 LMNA (0.45) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL23976261 0.85 METAP2 (0.44) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL25934447 0.83 KDM4E (0.40) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL23976561 0.82 NOTUM (0.50) KDM4EALDH1A1RAB9AKMT2AMEN1
SCHEMBL23975837 0.82 KDM4E (0.45) KDM4EALDH1A1HPGDRAB9AALPL
SCHEMBL23975816 0.82 L3MBTL1 (0.49) HPGDRAB9AKMT2AADORA2AADORA3
SCHEMBL25312800 0.81 NCOA3 (0.48) KMT2ASMN1; SMN2LMNA

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
WO-2021222359-A1 THIENO PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2021-11-04 — — WO disclosed
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