SCHEMBL6863219

SCHEMBL6863219

CCOC(=O)c1oc2cccc(OCCCNC3CCN(Cc4cccnc4)CC3)c2c1C

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NMT2 O60551 15/20 0.68
NMT1 P30419 15/20 0.68
ADRB2 P07550 2/20 0.53
ADRB1 P08588 2/20 0.53
ADRB3 P13945 2/20 0.53

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
SCHEMBL6869318 0.91 NMT2 (0.65) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL6870953 0.88 NMT2 (0.52) NMT2NMT1
SCHEMBL6863780 0.86 NMT2 (0.64) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3476964 0.84 NMT1 (0.57) NMT2NMT1
SCHEMBL3472871 0.81 NMT2 (1.00) NMT2NMT1
SCHEMBL3470645 0.81 NMT2 (0.85) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL6871614 0.80 NMT2 (0.57) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL6863185 0.80 NMT2 (0.65) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL6870905 0.78 MAOB (0.49) NMT2NMT1
SCHEMBL6863786 0.78 KDM4E (0.49) NMT2NMT1

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-1149094-B1 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS BASILEA PHARMACEUTICA AG (CH) 2004-04-21 EP claimed
US-6376491-B1 BENZOFURAN DERIVATIVES FOR TREATMENT OR PREVENTION OF MYCOSIS IN MAMMALS BASILEA PHARMACEUTICA AG (CH) 2002-04-23 US claimed
EP-1149094-B1 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS BASILEA PHARMACEUTICA AG (CH) 2004-04-21 EP disclosed
US-6376491-B1 BENZOFURAN DERIVATIVES FOR TREATMENT OR PREVENTION OF MYCOSIS IN MAMMALS BASILEA PHARMACEUTICA AG (CH) 2002-04-23 US disclosed
EP-1149094-A2 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS Basilea Pharmaceutica AG (CH) 2001-10-31 EP disclosed
WO-2000037464-A2 4-(AMINOALKOXY)BENZOFURANS AS N-MYRISTOYLTRANSFERASE INHIBITORS BASILEA PHARMACEUTICA AG (CH) 2000-06-29 WO disclosed