SCHEMBL9161071

SCHEMBL9161071

CN(C)c1ccc(/N=N/c2ccc(C=C(C#N)S(C)(=O)=O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.51
KMT2A Q03164 7/20 0.51
ALDH1A1 P00352 7/20 0.51
MAPT P10636 6/20 0.51
RAB9A P51151 4/20 0.46
NPC1 O15118 4/20 0.46
CA12 O43570 3/20 0.46
CA2 P00918 3/20 0.46
CA9 Q16790 3/20 0.46
POLB P06746 2/20 0.46
MAPK1 P28482 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
F2 P00734 3/20 0.44
PRSS1 P07477 3/20 0.44
PRSS2 P07478 3/20 0.44
PRSS3 P35030 3/20 0.44
KDM4E B2RXH2 1/20 0.43
TSHR P16473 2/20 0.42
ALOX15 P16050 1/20 0.42
CA1 P00915 1/20 0.42

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
SCHEMBL9161067 1.00 MEN1 (0.51) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9162141 0.92 ALDH1A1 (0.60) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9162134 0.92 ALDH1A1 (0.60) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9247214 0.85 APP (0.41) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9247207 0.85 APP (0.41) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9247221 0.85 APP (0.41) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9248241 0.81 MMP14 (0.36) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9248235 0.81 MMP14 (0.36) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL9248245 0.81 MMP14 (0.36) MEN1KMT2AALDH1A1MAPTRAB9A
SCHEMBL6003816 0.80 KMT2A (0.81) MEN1KMT2AALDH1A1MAPTRAB9A

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
US-5410630-A Optical article containing a polymer exhibiting a high level of second order polarization susceptibility EASTMAN KODAK COMPANY (US) 1995-04-25 US disclosed