SCHEMBL25124635

SCHEMBL25124635

Clc1ccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc3cccc(-c4ccccc4)c23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
MAP4K4 O95819 1/20 0.46
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTRC Q99895 1/20 0.40
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A2 O94788 1/20 0.39
ALDH1A3 P47895 1/20 0.39
EDNRB P24530 1/20 0.39
EDNRA P25101 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL25124609 0.93 CYP1A2 (0.45) CYP1A2MAP4K4KDM4EALDH1A1POLB
SCHEMBL25125407 0.88 CYP1A2 (0.60) CYP1A2MAP4K4KDM4EALDH1A1POLB
SCHEMBL28017773 0.88 ALDH1A1 (0.46) KDM4EALDH1A1HSD17B1HSD17B2L3MBTL1
SCHEMBL19203099 0.86 ALDH1A1 (0.48) CYP1A2MAP4K4KDM4EALDH1A1L3MBTL1
SCHEMBL24725941 0.86 CYP1A2 (0.56) CYP1A2MAP4K4KDM4EALDH1A1LMNA
SCHEMBL25125124 0.85 CYP1A2 (0.52) CYP1A2MAP4K4KDM4EALDH1A1POLB
SCHEMBL25858399 0.84 CYP1A2 (0.42) CYP1A2MAP4K4KDM4EALDH1A1POLB
SCHEMBL25124757 0.81 ALDH1A1 (0.56) CYP1A2MAP4K4KDM4EALDH1A1POLB
SCHEMBL25125411 0.81 ALDH1A1 (0.56) CYP1A2MAP4K4KDM4EALDH1A1POLB
SCHEMBL25125280 0.81 CYP1A2 (0.47) CYP1A2MAP4K4KDM4EALDH1A1POLB

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-20230111469-A1 Organic Electronic Device DUK SAN NEOLUX CO., LTD. (KR) 2023-04-13 US disclosed