SCHEMBL25873443

SCHEMBL25873443

c1ccc2c(c1)ccc1oc3cc(-c4ccc(N(c5ccc6c(c5)sc5ccccc56)c5ccc6sc7ccccc7c6c5)cc4)ccc3c12

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.33
ABCG2 Q9UNQ0 5/20 0.33
TDP1 Q9NUW8 3/20 0.33
PAX8 Q06710 2/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 2/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
FYN P06241 1/20 0.33
MAPK3 P27361 1/20 0.33
AHR P35869 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NQO1 P15559 1/20 0.30
NQO2 P16083 1/20 0.30
GPR3 P46089 1/20 0.30

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
SCHEMBL25517597 0.97 ABCG2 (0.34) APPABCG2TDP1PAX8RAB9A
SCHEMBL25873364 0.95 TDP1 (0.36) APPABCG2TDP1PAX8RAB9A
SCHEMBL25872877 0.94 ABCG2 (0.38) APPABCG2TDP1PAX8RAB9A
SCHEMBL25517708 0.94 ABCG2 (0.36) APPABCG2TDP1PAX8RAB9A
SCHEMBL25515924 0.94 ABCG2 (0.38) ABCG2TDP1PAX8RAB9ANPC1
SCHEMBL25873087 0.93 CA12 (0.33) APPABCG2TDP1PAX8RAB9A
SCHEMBL25873227 0.92 ABCG2 (0.36) APPABCG2TDP1PAX8RAB9A
SCHEMBL25870964 0.91 TDP1 (0.33) APPTDP1RAB9AL3MBTL1ALDH1A1
SCHEMBL25873444 0.91 ABCG2 (0.34) APPABCG2TDP1PAX8RAB9A
SCHEMBL25873438 0.91 TDP1 (0.37) ABCG2TDP1PAX8RAB9ANPC1

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
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed