SCHEMBL30845754

SCHEMBL30845754

Cc1nc(-c2ccc3nc(C(N)=O)cn3c2)no1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.48
PLK1 P53350 1/20 0.46
EGLN1 Q9GZT9 6/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
LMNA P02545 2/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMYD3 Q9H7B4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
NR4A2 P43354 1/20 0.37
MAPT P10636 1/20 0.37
MAPK14 Q16539 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
SCHEMBL21014266 0.88 PLK1 (0.47) PLK1EGLN1CA12CA1CA2
SCHEMBL21001692 0.84 KDM4E (0.54) PLK1EGLN1LMNATSHRNFKB1
SCHEMBL30845769 0.84 TGFBR1 (0.46) TGFBR1EGLN1HTT
SCHEMBL29382012 0.82 HDAC6 (0.50) TGFBR1EGLN1
SCHEMBL30845747 0.82 SMN1; SMN2 (0.50) TGFBR1EGLN1LMNATSHRRAB9A
SCHEMBL30845795 0.79 TGFBR1 (0.48) TGFBR1EGLN1
SCHEMBL8065354 0.76 TGFBR1 (0.50) TGFBR1EGLN1LMNATSHRRAB9A
SCHEMBL30845768 0.75 TGFBR1 (0.54) TGFBR1EGLN1NR4A2
SCHEMBL5843831 0.74 PLK1 (0.67) PLK1CA12CA1CA2CA9
SCHEMBL30845779 0.74 TGFBR1 (0.58) TGFBR1EGLN1

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-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN claimed
CN-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN disclosed