SCHEMBL7042865

SCHEMBL7042865

Cc1c(C(N)=O)oc2cccc(OCCCNC(C)(C)C)c12

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NMT2 O60551 17/20 0.77
NMT1 P30419 17/20 0.77
ADRB2 P07550 3/20 0.77
ADRB1 P08588 3/20 0.77
ADRB3 P13945 3/20 0.77
EDNRA P25101 1/20 0.47

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
Hydrochloric Acid SCHEMBL6872183 0.89 NMT2 (0.77) NMT2NMT1ADRB2ADRB1ADRB3
Hydrochloric Acid SCHEMBL6872178 0.88 NMT2 (0.75) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL6871813 0.87 NMT2 (1.00) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3471593 0.84 NMT2 (1.00) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL6874240 0.83 NMT2 (1.00) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3477347 0.83 NMT2 (1.00) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3472660 0.79 NMT2 (0.76) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3471905 0.78 NMT2 (0.75) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3470617 0.78 NMT2 (0.64) NMT2NMT1ADRB2ADRB1ADRB3
SCHEMBL3471346 0.77 NMT2 (0.78) NMT2NMT1ADRB2ADRB1ADRB3

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-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