SCHEMBL30633340

SCHEMBL30633340

CCOC(=O)c1cc2c(-c3ccc4[nH]nc(N)c4c3)ccnc2[nH]1.Nc1n[nH]c2ccc(-c3ccnc4[nH]c(C(=O)NC5CCCCC5)cc34)cc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 2/20 0.49
▸ TBK1 Q9UHD2 2/20 0.46
▸ DYRK1A Q13627 12/20 0.46
▸ WNT1 P04628 6/20 0.46
▸ MMP13 P45452 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ HSD17B10 Q99714 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
SCHEMBL26685912 0.91 NUDT1 (0.57) NUDT1TBK1DYRK1AWNT1
SCHEMBL31420121 0.91 NUDT1 (0.57) NUDT1TBK1DYRK1AWNT1
SCHEMBL31240280 0.90 NUDT1 (0.58) NUDT1TBK1DYRK1AWNT1
SCHEMBL26686119 0.90 NUDT1 (0.58) NUDT1TBK1DYRK1AWNT1
SCHEMBL31240624 0.88 MMP13 (0.49) NUDT1DYRK1AMMP13
SCHEMBL26685885 0.88 MMP13 (0.49) NUDT1DYRK1AMMP13
SCHEMBL30633395 0.83 MMP13 (0.45) NUDT1DYRK1AMMP13HPGD
SCHEMBL31240758 0.83 MMP13 (0.44) NUDT1DYRK1AMMP13
SCHEMBL30633398 0.79 NUDT1 (0.46) NUDT1DYRK1A
SCHEMBL26686152 0.79 NUDT1 (0.46) NUDT1DYRK1A

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
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 — — EP disclosed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 — — WO disclosed
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