SCHEMBL5577019

SCHEMBL5577019

CC(C)(C)OC(=O)c1ccc(/N=N/c2ccc(O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
MAPT P10636 3/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
CA12 O43570 4/20 0.48
CA9 Q16790 4/20 0.48
CA14 Q9ULX7 4/20 0.48
CA7 P43166 3/20 0.48
MAPK1 P28482 1/20 0.46
ELANE P08246 1/20 0.46
NPC1 O15118 3/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 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
SCHEMBL5577021 1.00 RAB9A (0.49) RAB9AMAPTCASP3SENP8SENP7
SCHEMBL38810 0.89 CA12 (0.59) RAB9AMAPTCA1CA2CA12
SCHEMBL22301323 0.89 ELANE (0.42) RAB9AMAPTCASP3SENP8SENP7
SCHEMBL22301322 0.89 ELANE (0.42) RAB9AMAPTCASP3SENP8SENP7
SCHEMBL11887265 0.86 MAPT (0.67) RAB9AMAPTCASP3SENP8SENP7
Ethylene SCHEMBL27622376 0.85 CA12 (0.55) RAB9AMAPTCA1CA2CA12
SCHEMBL19497926 0.84 CA12 (0.63) RAB9AMAPTCA1CA2CA12
SCHEMBL109451 0.81 CA1 (0.61) CA1CA2CA12CA9CA14
SCHEMBL23986228 0.80 CA1 (0.77) RAB9AMAPTCASP3SENP8SENP7
SCHEMBL12369105 0.80 CA1 (0.50) RAB9AMAPTCASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263192-B2 Methods for modifying surfaces THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-09-11 US disclosed
US-20070134420-A1 Methods for modifying surfaces THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2007-06-14 US disclosed
WO-2005060668-A2 METHODS OF MODIFYING SURFACES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OFNEW YORK (US) 2005-07-07 WO disclosed