SCHEMBL7283847

SCHEMBL7283847

CC(C)(C)OC(=O)COc1ccc(C(=O)NNC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1OCC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.45
▸ LMNA P02545 2/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ S1PR2 O95136 1/20 0.41
▸ PDE4A P27815 2/20 0.41
▸ PDE4B Q07343 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ STS P08842 1/20 0.40
▸ ATM Q13315 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ CFTR P13569 1/20 0.38

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
SCHEMBL8355692 0.87 KMT2A (0.64) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7290311 0.84 KMT2A (0.48) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL8357832 0.84 KMT2A (0.48) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7280685 0.84 KMT2A (0.48) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7289312 0.77 PTPRC (0.41) KMT2ANPSR1MEN1SMN1; SMN2CYP2C19
SCHEMBL8359470 0.76 HDAC3 (0.32) KMT2ANPSR1MEN1SMN1; SMN2HTT
SCHEMBL7289605 0.74 HDAC1 (0.48) KMT2AMEN1PDE4APDE4BPDE4C
SCHEMBL7292267 0.74 SMPD1 (0.47) KMT2AMEN1SMN1; SMN2MAPTKDM4E
SCHEMBL7284623 0.73 TSHR (0.51) KMT2ANPSR1LMNAMEN1CYP2C19
SCHEMBL7289755 0.72 ROCK2 (0.45) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5981531-A FOR INHIBITING PLATELET AGGREGATION ZENECA LIMITED (GB) 1999-11-09 — — US disclosed
EP-0632016-B1 1,2-Diacylated hydrazine derivatives and their use as cell adhesion inhibitors ZENECA LTD (GB) 1997-04-09 — — EP disclosed
US-5612373-A ANTICOAGULANTS ZENECA LIMITED (GB) 1997-03-18 — — US disclosed
WO-1995000472-A1 1,2 DIACYLATED HYDRAZINE DERIVATIVES AND THEIR USE AS ALL ADHESION INHIBITORS ZENECA LIMITED (GB) 1995-01-05 — — WO disclosed
EP-0632016-A1 1,2-Diacylated hydrazine derivatives and their use as cell adhesion inhibitors ZENECA LIMITED (GB) 1995-01-04 — — EP disclosed
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