SCHEMBL5225056

SCHEMBL5225056

COc1ccc(-c2cc(N(C)C)nnc2-c2ccc(OC)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK11 Q15759 5/20 0.57
MAPK14 Q16539 5/20 0.57
CSNK1D P48730 4/20 0.57
ABL1 P00519 1/20 0.45
ABCB1 P08183 1/20 0.45
BCR P11274 1/20 0.45
ADK P55263 1/20 0.44
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 1/20 0.41
MITF O75030 1/20 0.41
PKM P14618 1/20 0.41
MAOB P27338 1/20 0.41
AGTR1 P30556 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL5222119 0.77 KMT2A (0.44) ABL1ABCB1BCRMAPTKDM4E
SCHEMBL5226722 0.75 KMT2A (0.43) ABL1ABCB1BCRMAPTKDM4E
SCHEMBL5227004 0.74 NPC1 (0.62) ABL1ABCB1BCRMAPTKDM4E
SCHEMBL5227509 0.74 MAPT (0.55) ABL1ABCB1BCRMAPTKDM4E
SCHEMBL5224164 0.74 ADORA1 (0.49) ABL1ABCB1BCRMAPTKDM4E
SCHEMBL5223497 0.73 SMN1; SMN2 (0.54) MAPTKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL5225103 0.73 PTGS2 (0.48) MAPTKDM4EALDH1A1HPGDKMT2A
SCHEMBL1752996 0.73 MAPK14 (1.00) MAPK11MAPK14CSNK1DNPC1PKM
SCHEMBL5225376 0.73 ALOX5 (0.51) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL5227512 0.73 KMT2A (0.48) ABL1ABCB1BCRMAPTKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300399-B1 PHENYLPYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2007-08-22 EP disclosed
US-6664256-B1 Interleukin- 1 beta inhibitors KOWA CO., LTD. (JP) 2003-12-16 US disclosed
EP-1300399-A1 PHENYLPYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME Kowa Co., Ltd. (JP) 2003-04-09 EP disclosed