SCHEMBL28777818

SCHEMBL28777818

CC(C)(C)c1cc2ccccc2c(Br)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.44
▸ CA2 P00918 3/20 0.41
▸ CA1 P00915 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ TYR P14679 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GRIN2D O15399 1/20 0.39
▸ GRIN2A Q12879 1/20 0.39
▸ GRIN2B Q13224 1/20 0.39
▸ GRIN2C Q14957 1/20 0.39
▸ TRPM4 Q8TD43 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ ERBB2 P04626 1/20 0.38
▸ IGF1R P08069 1/20 0.38
▸ HPGD P15428 1/20 0.37

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
SCHEMBL29253052 0.95 POLB (0.41) POLBCA2CA1MEN1GAA
SCHEMBL28777891 0.95 POLB (0.41) POLBCA2CA1MEN1GAA
SCHEMBL19196664 0.83 CA2 (0.45) POLBCA2CA1MEN1GAA
SCHEMBL2295837 0.81 CA2 (0.43) POLBCA2CA1MEN1GAA
SCHEMBL8338477 0.80 CA2 (0.42) POLBCA2CA1MEN1GAA
SCHEMBL19195708 0.77 TRPM4 (0.41) POLBCA2CA1MEN1GAA
SCHEMBL11230863 0.76 CA2 (0.42) POLBCA2CA1MEN1GAA
SCHEMBL29253051 0.76 ALDH1A1 (0.36) POLBMEN1GAAKMT2AALDH1A1
SCHEMBL1699269 0.76 LMNA (0.48) POLBALDH1A1TSHRTDP1GRIN2D
SCHEMBL6600451 0.75 POLB (0.52) POLBCA2CA1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114685762-B Preparation method of hydrophobic bisphosphite organic polymer 陕西延长石油(集团)有限责任公司 2023-09-05 — — CN disclosed
CN-114685762-A Preparation method of hydrophobic bisphosphite organic polymer 陕西延长石油(集团)有限责任公司 2022-07-01 — — CN disclosed
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