SCHEMBL17828540

SCHEMBL17828540

Cc1cccc(N(c2cccc(C)c2)c2ccc(N(c3cccc(C)c3)c3cccc(C)c3)c3c2-c2ccc4c5c(ccc-3c25)-c2c-4c(N(c3cccc(C)c3)c3cccc(C)c3)c3ccccc3c2N(c2cccc(C)c2)c2cccc(C)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.33
PER2 O15055 1/20 0.32
CRY1 Q16526 1/20 0.32
CRY2 Q49AN0 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
CASP1 P29466 1/20 0.31
HTT P42858 1/20 0.31
CASP7 P55210 1/20 0.31
HBB P68871 1/20 0.31
KMT2A Q03164 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL134672 0.93 SIGMAR1 (0.36) SIGMAR1PER2CRY1CRY2KDM4E
SCHEMBL17828542 0.84 KDM4E (0.31) KDM4EALDH1A1MAPT
SCHEMBL13832168 0.80 MAPT (0.41) SIGMAR1KDM4EMEN1USP2ALDH1A1
SCHEMBL14010656 0.78 MEN1 (0.36) SIGMAR1KDM4EMEN1USP2ALDH1A1
SCHEMBL13511241 0.78 ACHE (0.44) SIGMAR1PER2CRY1CRY2KDM4E
SCHEMBL29555509 0.78 ACHE (0.44) SIGMAR1PER2CRY1CRY2KDM4E
SCHEMBL10128581 0.77 ACHE (0.42) SIGMAR1PER2CRY1CRY2KDM4E
SCHEMBL5144122 0.77 ACHE (0.42) SIGMAR1PER2CRY1CRY2KDM4E
SCHEMBL19829576 0.76 SIGMAR1 (0.37) SIGMAR1PER2CRY1CRY2KDM4E
SCHEMBL13242040 0.76 SIGMAR1 (0.37) SIGMAR1KDM4EMEN1USP2ALDH1A1

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-9997717-B2 Organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-06-12 US disclosed
US-20160172601-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 US disclosed