SCHEMBL29131689

SCHEMBL29131689

CC(C)(C)c1cc(O)cc(C(C)(C)C)c1OP(O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
ALOX15 P16050 4/20 0.42
CYP2C9 P11712 2/20 0.42
TYR P14679 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
NR1I2 O75469 1/20 0.42
MIF P14174 1/20 0.42
NFE2L2 Q16236 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 3/20 0.39
CYP1A2 P05177 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATP2A2 P16615 1/20 0.39
ATP2A3 Q93084 1/20 0.39
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
CA2 P00918 4/20 0.37
CA1 P00915 2/20 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
SCHEMBL31366151 0.88 ALDH1A1 (0.42) ALDH1A1ALOX15CYP2C9TYRLMNA
SCHEMBL1664850 0.83 SMN1; SMN2 (0.50) ALDH1A1ALOX15CYP2C9TYRHSD17B10
SCHEMBL5865457 0.83 GABRA1 (0.38) ALDH1A1ALOX15CYP2C9TYRLMNA
SCHEMBL28128152 0.80 CA1 (0.57) ALDH1A1ALOX15LMNASMN1; SMN2MAPT
SCHEMBL27361196 0.77 ALDH1A1 (0.33) ALDH1A1ALOX15CYP2C9LMNAHTT
Catechol SCHEMBL9355747 0.77 ALDH1A1 (0.44) ALDH1A1ALOX15CYP2C9TYRLMNA
Catechol SCHEMBL9356105 0.77 ALDH1A1 (0.48) ALDH1A1ALOX15CYP2C9TYRLMNA
SCHEMBL1649534 0.77 CA2 (0.48) ALDH1A1GABRA1GABRB2CA2TDP1
SCHEMBL3157771 0.76 TDP1 (0.52) ALDH1A1ALOX15CYP2C9TYRLMNA
SCHEMBL28861328 0.75 ALDH1A1 (0.52) ALDH1A1ALOX15CYP2C9TYRLMNA

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-117186781-A Photovoltaic module packaging adhesive film and preparation method and application thereof 万华化学集团股份有限公司 2023-12-08 CN claimed
CN-117186781-A Photovoltaic module packaging adhesive film and preparation method and application thereof 万华化学集团股份有限公司 2023-12-08 CN disclosed