SCHEMBL14645485

SCHEMBL14645485

CCCCC(CC)COc1ccc(N(c2ccc(Br)cc2)c2ccc(OCC(CC)CCCC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 5/20 0.44
CYP3A4 P08684 5/20 0.44
LMNA P02545 2/20 0.44
HSD17B10 Q99714 1/20 0.44
APP P05067 2/20 0.42
CA2 P00918 1/20 0.40
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 2/20 0.36
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL13321986 1.00 TDP1 (0.50) TDP1KDM4EMAPK1ALDH1A1CYP3A4
SCHEMBL677334 0.93 TDP1 (0.52) TDP1KDM4EMAPK1ALDH1A1CYP3A4
SCHEMBL14337698 0.93 TDP1 (0.52) TDP1KDM4EMAPK1ALDH1A1CYP3A4
SCHEMBL8943687 0.88 CYP3A4 (0.46) TDP1KDM4EMAPK1ALDH1A1CYP3A4
SCHEMBL8943702 0.87 TDP1 (0.50) TDP1MAPK1ALDH1A1CYP3A4LMNA
SCHEMBL8943906 0.87 ALDH1A1 (0.47) TDP1KDM4EMAPK1ALDH1A1CYP3A4
SCHEMBL2856507 0.86 CYP3A4 (0.44) TDP1KDM4EMAPK1ALDH1A1CYP3A4
SCHEMBL1357035 0.84 ALDH1A1 (0.50) TDP1MAPK1ALDH1A1CYP3A4LMNA
SCHEMBL1356320 0.84 ALDH1A1 (0.50) TDP1MAPK1ALDH1A1CYP3A4LMNA
SCHEMBL18493494 0.84 TDP1 (0.46) TDP1KDM4EMAPK1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059953-A Three-bond-containing carbazole photosensitive dye and synthetic method and application thereof 大连理工大学 2026-05-19 CN claimed
CN-122059953-A Three-bond-containing carbazole photosensitive dye and synthetic method and application thereof 大连理工大学 2026-05-19 CN disclosed
WO-2013008951-A1 ORGANIC DYE, DYE-SENSITIZED METAL OXIDE SEMICONDUCTOR ELECTRODE AND DYE-SENSITIZED SOLAR CELL NATIONAL INSTITUTE FOR MATERIALS SCIENCE (JP) 2013-01-17 WO disclosed