SCHEMBL102795

SCHEMBL102795

C=C(C)c1ccc(/N=N/c2ccc(-c3ccc(C(=C)C)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.50
NPC1 O15118 8/20 0.50
RAB9A P51151 7/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
TDP1 Q9NUW8 3/20 0.50
MAPK1 P28482 2/20 0.50
STAT3 P40763 1/20 0.50
STAT1 P42224 1/20 0.50
KDM4E B2RXH2 1/20 0.41
TRPA1 O75762 1/20 0.39
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
POLB P06746 2/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 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
SCHEMBL103595 0.93 NPC1 (0.56) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL9516265 0.85 MAPT (0.44) MAPTSMN1; SMN2L3MBTL1HSD17B1LMNA
SCHEMBL19749969 0.84 TRPA1 (0.57) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL25645179 0.79 NPC1 (0.68) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL56361 0.77 MAPT (0.40) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL9514759 0.76 HSD17B1 (0.60) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4502407 0.76 SMN1; SMN2 (0.60) MAPTNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL23268269 0.74 HSD17B1 (0.37) MAPTSMN1; SMN2TDP1HSD17B1HPGD
SCHEMBL12826491 0.74 ALDH1A1 (0.43) MAPTNPC1RAB9ASMN1; SMN2TDP1
SCHEMBL21133359 0.74 HSD17B1 (0.37) MAPTSMN1; SMN2CASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8992796-B2 Polymerizable liquid crystal composition DIC CORPORATION (JP) 2015-03-31 US disclosed
US-20120056129-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION DIC CORPORATION (JP) 2012-03-08 US disclosed