SCHEMBL1701986

SCHEMBL1701986

CCOC(=O)c1ccc(N=Nc2ccc(CCCCCCO)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 4/20 0.58
CYP4F2 P78329 3/20 0.58
MAPT P10636 2/20 0.55
RAB9A P51151 2/20 0.55
NPC1 O15118 1/20 0.55
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ESR1 P03372 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
ESR2 Q92731 1/20 0.46
CA14 Q9ULX7 1/20 0.46
ACHE P22303 1/20 0.45
CYP1A2 P05177 2/20 0.45
LMNA P02545 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAOA P21397 1/20 0.45
NOS3 P29474 2/20 0.45
NOS1 P29475 2/20 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
SCHEMBL15122388 1.00 CYP4A11 (0.58) CYP4A11CYP4F2MAPTRAB9ANPC1
SCHEMBL4130116 0.90 CYP4A11 (0.71) CYP4A11CYP4F2RAB9ANPC1CA12
SCHEMBL18821726 0.87 MAPT (0.58) CYP4A11CYP4F2MAPTRAB9ANPC1
SCHEMBL3049924 0.85 CYP4A11 (0.70) CYP4A11CYP4F2RAB9ANPC1CA12
SCHEMBL3080726 0.82 MAPT (0.75) MAPTRAB9ANPC1CA12CA1
SCHEMBL3080728 0.82 MAPT (0.75) MAPTRAB9ANPC1CA12CA1
SCHEMBL6123675 0.81 THRA (0.59) MAPTCA12CA1CA2ESR1
SCHEMBL12040863 0.81 THRA (0.59) MAPTCA12CA1CA2ESR1
SCHEMBL3796237 0.81 THRA (0.59) MAPTCA12CA1CA2ESR1
SCHEMBL6900234 0.81 THRA (0.59) MAPTCA12CA1CA2ESR1

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-9158134-B2 Light-sensitive compound, polymer polymerized with light-sensitive compound and preparation method thereof INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY (KR) 2015-10-13 US disclosed
US-20130188120-A1 COMPOUND HAVING PHOTOSENSITIVITY, POLYMER FORMED BY POLYMERIZING THE COMPOUND, AND PRODUCTION METHOD THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY (KR) 2013-07-25 US disclosed
WO-2012002590-A1 COMPOUND HAVING PHOTOSENSITIVITY, POLYMER FORMED BY POLYMERIZING THE COMPOUND, AND PRODUCTION METHOD THEREOF 한양대학교 산학협력단 (KR) 2012-01-05 WO disclosed