SCHEMBL31265044

SCHEMBL31265044

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2COP(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 4/20 0.43
▸ RORA P35398 4/20 0.43
▸ RORC P51449 4/20 0.43
▸ RORB Q92753 4/20 0.43
▸ DNMT1 P26358 3/20 0.42
▸ PTGES2 Q9H7Z7 1/20 0.42
▸ HTR1D P28221 1/20 0.38
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ PON1 P27169 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ SERPINE1 P05121 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33

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
SCHEMBL31005871 0.85 PGR (0.44) PGRRORARORCRORBDNMT1
SCHEMBL31265056 0.83 RORA (0.48) PGRRORARORCRORBDNMT1
SCHEMBL31265112 0.82 PGR (0.47) PGRRORARORCRORBDNMT1
SCHEMBL31265066 0.81 HSD17B10 (0.40) PGRRORARORCRORBALDH1A1
SCHEMBL31265091 0.81 PGR (0.46) PGRRORARORCRORBDNMT1
SCHEMBL31265080 0.81 PGR (0.46) PGRRORARORCRORBDNMT1
SCHEMBL31240093 0.80 RORA (0.46) PGRRORARORCRORBDNMT1
SCHEMBL21341470 0.79 HDAC10 (0.39) HDAC6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL31240146 0.77 RORA (0.47) PGRRORARORCRORBDNMT1
SCHEMBL31240191 0.75 RORA (0.51) PGRRORARORCRORBDNMT1

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
CN-119136623-A Preparation method of self-assembled monolayer in perovskite battery 无锡永珈光能科技有限公司 2024-12-13 — — CN claimed
CN-119136623-A Preparation method of self-assembled monolayer in perovskite battery 无锡永珈光能科技有限公司 2024-12-13 — — CN disclosed
CN-119012725-A Hole transport layer and method for producing same 天合光能股份有限公司 2024-11-22 — — CN disclosed
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