SCHEMBL16674530

SCHEMBL16674530

Cc1ccc(-c2nnc(-c3ccc(C)s3)nn2)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 2/20 0.45
GFER P55789 1/20 0.45
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 3/20 0.38
TP53 P04637 2/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
HPGD P15428 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
DAO P14920 1/20 0.36
CASP3 P42574 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
SCHEMBL29764 0.82 NPC1 (0.52) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL23665594 0.80 NPC1 (0.33) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL23665420 0.80 MAPT (0.37) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL12170048 0.79 NPC1 (0.50) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL12982405 0.79 NPC1 (0.50) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL11997754 0.79 NPC1 (0.50) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL12982161 0.79 NPC1 (0.50) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL120939 0.79 NPC1 (0.50) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL11996764 0.77 HDAC1 (0.48) NPC1MAPTALDH1A1HSD17B10GFER
SCHEMBL9927275 0.76 NPC1 (0.43) NPC1MAPTALDH1A1HSD17B10GFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220416167-A1 OSMIUM-CONTAINING CONJUGATED POLYMER AND METHODS THEREOF XIAMEN UNIVERSITY (CN) 2022-12-29 US disclosed
WO-2021143690-A1 OSMIUM-CONTAINING CONJUGATED POLYMER, PREPARATION METHOD THEREFOR AND USE THEREOF 厦门大学 2021-07-22 WO disclosed
US-20150114467-A1 DONOR-ACCEPTOR ALTERNATING CONJUGATED POLYMER AND SOLAR CELL DEVICE MANUFACTURED BY USING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2015-04-30 US disclosed
US-20150114467-A1 DONOR-ACCEPTOR ALTERNATING CONJUGATED POLYMER AND SOLAR CELL DEVICE MANUFACTURED BY USING THE SAME NATIONAL TAIWAN UNIVERSITY (TW) 2015-04-30 US disclosed