SCHEMBL31240146

SCHEMBL31240146

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2CCP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RORA P35398 7/20 0.47
RORC P51449 7/20 0.47
RORB Q92753 7/20 0.47
PGR P06401 6/20 0.47
DNMT1 P26358 3/20 0.43
HTR1D P28221 2/20 0.41
PTGES2 Q9H7Z7 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ANPEP P15144 1/20 0.38
ERAP2 Q6P179 1/20 0.38
PLK1 P53350 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
HTR1A P08908 1/20 0.35
HTR1B P28222 1/20 0.35
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL3214427 0.91 RORA (0.51) RORARORCRORBPGRDNMT1
SCHEMBL31240191 0.91 RORA (0.51) RORARORCRORBPGRDNMT1
SCHEMBL31240086 0.90 RORA (0.50) RORARORCRORBPGRDNMT1
SCHEMBL31240116 0.88 RORA (0.49) RORARORCRORBPGRDNMT1
SCHEMBL31240166 0.88 RORA (0.49) RORARORCRORBPGRDNMT1
Butane SCHEMBL3202948 0.87 RORA (0.54) RORARORCRORBPGRDNMT1
SCHEMBL31240093 0.84 RORA (0.46) RORARORCRORBPGRDNMT1
SCHEMBL30227040 0.81 HSD17B10 (0.44) RORARORCRORBPGRPLK1
SCHEMBL26597780 0.81 HSD17B10 (0.44) RORARORCRORBPGRPLK1
SCHEMBL31005871 0.81 PGR (0.44) RORARORCRORBPGRDNMT1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119053162-B Hole transport material and preparation method thereof, solar cell and preparation method thereof 天合光能股份有限公司 2025-02-18 CN disclosed
CN-119173053-A Solar cell and preparation method thereof 天合光能股份有限公司 2024-12-20 CN disclosed
CN-119173067-A Laminated solar cell and preparation method thereof 天合光能股份有限公司 2024-12-20 CN disclosed
CN-119053162-A Hole transport material and preparation method thereof, solar cell and preparation method thereof 天合光能股份有限公司 2024-11-29 CN disclosed
CN-119012724-A Solar cell and preparation method thereof 天合光能股份有限公司 2024-11-22 CN disclosed