SCHEMBL22880415

SCHEMBL22880415

c1ccc(-c2nc3ccc4ccc5cc(-c6cccc(-c7cc8ccccc8c8ccc9ccccc9c78)c6)ccc5c4c3o2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.43
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
ALDH1A1 P00352 8/20 0.38
MAPT P10636 5/20 0.38
KDM4E B2RXH2 5/20 0.38
HPGD P15428 4/20 0.38
CYP1A2 P05177 2/20 0.37
ERBB2 P04626 1/20 0.37
FYN P06241 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 1/20 0.37
AHR P35869 1/20 0.37
ELANE P08246 1/20 0.36
TSHR P16473 2/20 0.36
CASP1 P29466 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALOX15 P16050 1/20 0.36
CASP7 P55210 1/20 0.36
PTGES O14684 1/20 0.34

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
SCHEMBL21662281 0.93 DHODH (0.44) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL22880409 0.92 DHODH (0.43) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL21662280 0.91 DHODH (0.44) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL22880320 0.90 ESR1 (0.43) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL22880307 0.90 ESR1 (0.45) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL22880541 0.88 HSD17B10 (0.38) ESR1ESR2ALDH1A1MAPTKDM4E
SCHEMBL21662285 0.88 DHODH (0.43) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL22880323 0.87 ESR1 (0.43) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL22880306 0.86 DHODH (0.47) DHODHESR1ESR2ALDH1A1MAPT
SCHEMBL21662282 0.85 DHODH (0.43) DHODHESR1ESR2ALDH1A1MAPT

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
US-11793075-B2 Plurality of host materials and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. 2023-10-17 US disclosed
US-11793075-B2 Plurality of host materials and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. 2023-10-17 US disclosed
US-20210013427-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-01-14 US disclosed