SCHEMBL25877259

SCHEMBL25877259

CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4oc5ccc6ccccc6c5c4c3)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PRKDC P78527 1/20 0.33
ABCG2 Q9UNQ0 2/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAPK3 P27361 1/20 0.32
PAX8 Q06710 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL25877252 0.97 AHR (0.33) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL15851896 0.97 AHR (0.33) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL26489503 0.94 ABCG2 (0.33) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL25877060 0.93 AHR (0.35) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL25875801 0.93 ALK (0.32) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL25877342 0.92 ABCG2 (0.33) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL26489511 0.92 ABCG2 (0.33) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL9916436 0.92 ABCG2 (0.33) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL26489800 0.92 AHR (0.34) AHRKMT2AMEN1TP53CYP3A4
SCHEMBL25877191 0.92 ABCG2 (0.34) AHRKMT2AMEN1TP53CYP3A4

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-20230329025-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-10-12 US disclosed
US-20230329025-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-10-12 US disclosed
WO-2023190597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-05 WO disclosed
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed