SCHEMBL5223322

SCHEMBL5223322

COc1ccc(-c2cc(Oc3ccccc3)nnc2-c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.50
LTA4H P09960 1/20 0.49
SOAT1 P35610 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ABL1 P00519 1/20 0.45
ABCB1 P08183 1/20 0.45
BCR P11274 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MITF O75030 1/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 1/20 0.45
MAOB P27338 1/20 0.45
AGTR1 P30556 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL5226722 0.94 KMT2A (0.43) BTKSOAT1L3MBTL1LMNAALDH1A1
SCHEMBL5226694 0.87 KDM4E (0.43) BTKKDM4ENPC1
SCHEMBL5223724 0.84 SOAT1 (0.44) BTKSOAT1L3MBTL1LMNAALDH1A1
SCHEMBL5223318 0.83 KDM1A (0.48) ALDH1A1NPSR1KDM4ENPC1RAB9A
SCHEMBL5228063 0.83 KMT2A (0.40) SOAT1L3MBTL1ALDH1A1NPSR1KDM4E
SCHEMBL5225138 0.82 MEN1 (0.43) ALDH1A1NPC1RAB9AMAPTHTT
SCHEMBL5224031 0.82 CNR1 (0.38) SOAT1L3MBTL1ALDH1A1NPSR1KDM4E
SCHEMBL5221905 0.81 APP (0.49) L3MBTL1LMNAALDH1A1NPSR1KDM4E
SCHEMBL5224063 0.81 SOAT1 (0.42) SOAT1L3MBTL1LMNAALDH1A1NPSR1
SCHEMBL5223017 0.81 MAPT (0.39) SOAT1L3MBTL1LMNAALDH1A1NPSR1

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