SCHEMBL31442122

SCHEMBL31442122

CC(C)(c1ccccc1)c1ccc(OP(O)O)c(C(C)(C)c2ccccc2)c1.CC(C)(c1ccccc1)c1ccc(OP(O)O)c(C(C)(C)c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
ESR1 P03372 3/20 0.44
ESR2 Q92731 3/20 0.44
CYP3A4 P08684 2/20 0.44
CNR1 P21554 4/20 0.39
CNR2 P34972 4/20 0.39
NR3C2 P08235 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALOX15 P16050 1/20 0.34
KDM4E B2RXH2 5/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.33
AR P10275 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 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
SCHEMBL2242844 1.00 ALDH1A1 (0.44) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL29389008 1.00 ALDH1A1 (0.44) ALDH1A1ESR1ESR2CYP3A4CNR1
Hydrochloric Acid SCHEMBL28561683 0.98 ALDH1A1 (0.43) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL29286983 0.91 ALDH1A1 (0.44) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL25327244 0.90 ALDH1A1 (0.41) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL29413196 0.90 ALDH1A1 (0.41) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL2242839 0.87 ALDH1A1 (0.43) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL8444017 0.84 ESR1 (0.44) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL12151600 0.84 ALDH1A1 (0.41) ALDH1A1ESR1ESR2CYP3A4CNR1
SCHEMBL11429718 0.83 ALDH1A1 (0.41) ALDH1A1ESR1ESR2CYP3A4CNR1

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
CN-114752200-B Moisture-heat-resistant good-processing PC composition and preparation method and application thereof 金发科技股份有限公司 2025-03-25 CN disclosed