SCHEMBL7471206

SCHEMBL7471206

COc1cc(ON(C(C)=O)c2nc3ccccc3s2)ccc1C(=O)/C=C/C(=O)N1CCC(N2CCN(C)C(C)C2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ NPBWR1 P48145 1/20 0.40
▸ MCHR1 Q99705 1/20 0.40
▸ HCRTR2 O43614 4/20 0.39
▸ HCRTR1 O43613 3/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ KLF5 Q13887 1/20 0.38
▸ TP53 P04637 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ UBE2M P61081 3/20 0.34
▸ DCUN1D1 Q96GG9 3/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ KDM2B Q8NHM5 3/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ IKBKB O14920 1/20 0.34
▸ CHUK O15111 1/20 0.34
▸ IKBKG Q9Y6K9 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL7471211 1.00 KDM4E (0.40) KDM4EPOLBNPBWR1MCHR1HCRTR2
SCHEMBL7465681 0.89 KDM4E (0.40) KDM4EPOLBNPBWR1MCHR1HCRTR2
SCHEMBL7467159 0.87 HTR2B (0.37) POLBNPC1MAPTCHRM2KDM2B
SCHEMBL7471215 0.82 NPC1 (0.48) KDM4EHCRTR2HCRTR1NPC1KLF5
SCHEMBL7470152 0.81 KDM4E (0.35) KDM4EPOLBNPBWR1MCHR1NPC1
Hydrochloric Acid SCHEMBL7475856 0.78 MAPT (0.37) KDM4EPOLBNPC1TP53MAPT
SCHEMBL7469785 0.78 KDM4E (0.40) KDM4EPOLBNPBWR1MCHR1TP53
SCHEMBL7469782 0.78 KDM4E (0.40) KDM4EPOLBNPBWR1MCHR1TP53
SCHEMBL7473250 0.78 KDM4E (0.41) KDM4EPOLBNPBWR1MCHR1HCRTR2
SCHEMBL7468395 0.76 KDM4E (0.39) KDM4EPOLBNPBWR1MCHR1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0858452-B1 THIAZOLE DERIVATIVE AS PROTEIN KINASE C INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-03-13 — — EP claimed
US-6140330-A USEFUL AS PROTEIN KINASE INHIBITOR; FOR TREATMENT OF AUTOIMMUNE DISEASES SUCH AS RHEUMATOID ARTHRITIS, SYSTEMIC LUPUS ERYTHEMATOSUS, MULTIPLE SCLEROSIS, PSORIASIS, ETC., VARIOUS ALLERGIC DISEASES SUCH AS CROHN'S DISEASE, ASTHMA OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 2000-10-31 — — US claimed
EP-0858452-A1 THIAZOLE DERIVATIVE AS PROTEIN KINASE C INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-08-19 — — EP claimed
WO-1998004536-A1 THIAZOLE DERIVATIVE AS PROTEIN KINASE C INHIBITORS OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1998-02-05 — — WO claimed
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