SCHEMBL27958262

SCHEMBL27958262

CCNc1ccc(C=[N+]([O-])c2ccc(C(C)=O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
MAPK1 P28482 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 2/20 0.46
POLB P06746 4/20 0.38
GAA P10253 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
ALDH1A1 P00352 2/20 0.37
GLA P06280 1/20 0.37
MCL1 Q07820 1/20 0.37
NOX1 Q9Y5S8 1/20 0.37
MAOB P27338 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36

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
SCHEMBL27958261 0.85 L3MBTL1 (0.48) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL14776736 0.83 MAPT (0.55) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL27958256 0.80 MAPT (0.58) MAPTMEN1KMT2ANPC1GAA
SCHEMBL27951883 0.80 MAPT (0.56) MAPTLMNANPC1ALDH1A1
SCHEMBL4579781 0.79 MAPT (0.51) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL11406392 0.79 MAPT (0.59) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL506330 0.78 MAPT (0.52) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL11405837 0.78 G6PD (0.57) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL11405207 0.78 MAPT (0.57) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL27958255 0.77 MAPT (0.46) MAPTLMNASMN1; SMN2NPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103796993-A Photoreactive dye for holographic storage medium SABIC INNOVATIVE PLASTICS IP 2014-05-14 CN disclosed