SCHEMBL25825670

SCHEMBL25825670

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6ccc7c8c(cccc68)-c6ccccc6-7)cc5)c5ccccc45)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
ADORA3 P0DMS8 2/20 0.41
ADORA2A P29274 2/20 0.41
ADORA2B P29275 2/20 0.41
ADORA1 P30542 2/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 5/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
ATM Q13315 4/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPK1 P28482 3/20 0.40
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL27129049 0.98 CRHBP (0.42) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL25823008 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL18878320 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL18878312 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL14079814 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL23099287 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL25822850 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL19271445 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL23546600 0.97 CRHBP (0.43) TSHRADORA3ADORA2AADORA2BADORA1
SCHEMBL23099295 0.95 TSHR (0.40) TSHRADORA3ADORA2AADORA2BADORA1

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-2023125801-A1 FLUORANTHENE DERIVATIVE, LIGHT-EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT 东丽先端材料研究开发(中国)有限公司 2023-07-06 WO disclosed