SCHEMBL29015802

SCHEMBL29015802

Cc1cc(-c2ccccc2-c2cc(C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.71
CYP2C9 P11712 1/20 0.71
CYP2C19 P33261 1/20 0.71
CA2 P00918 4/20 0.52
CA1 P00915 2/20 0.52
GABRA1 P14867 1/20 0.50
GABRB2 P47870 1/20 0.50
PTPN1 P18031 1/20 0.49
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 1/20 0.45
TYR P14679 1/20 0.45
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
PTGS1 P23219 2/20 0.39
PTGS2 P35354 2/20 0.39
EGFR P00533 1/20 0.38

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
SCHEMBL31006760 0.88 CA2 (0.67) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL11427045 0.85 CA2 (0.57) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL13840639 0.85 CYP1A2 (0.78) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL8772437 0.85 CYP1A2 (0.61) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL9291385 0.85 CYP2C9 (0.56) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL2343165 0.84 CYP2C9 (1.00) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL16581433 0.81 CYP1A2 (0.78) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL9295085 0.80 CA2 (0.47) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL30917970 0.80 CYP2C9 (0.69) CYP1A2CYP2C9CYP2C19CA2CA1
SCHEMBL18763607 0.80 CYP2C9 (0.69) CYP1A2CYP2C9CYP2C19CA2CA1

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-109891320-B Metal oxide photosensitive resin composition, color filter and image display device manufactured using the same 东友精细化工有限公司 2023-06-20 CN disclosed