SCHEMBL29130830

SCHEMBL29130830

Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1OP(O)Cl

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.34
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
HTR1D P28221 2/20 0.32
HTR1B P28222 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RXRA P19793 2/20 0.31
PPARG P37231 2/20 0.31
RARG P13631 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CA2 P00918 1/20 0.31
TYR P14679 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSP90AA1 P07900 1/20 0.30

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
SCHEMBL7147241 0.86 HSP90AA1 (0.36) GABRA1GABRB2RXRAPPARGRARG
SCHEMBL8356242 0.86 POLB (0.36) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL28542242 0.86 POLB (0.36) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL8519938 0.86 POLB (0.36) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL29413912 0.86 POLB (0.36) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL9237411 0.86 POLB (0.36) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL30692863 0.86 POLB (0.36) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL29130833 0.83 POLB (0.32) POLBGABRA1GABRB2HTR1DHTR1B
SCHEMBL9328498 0.82 ALDH1A1 (0.34) CYP1A2CYP2C9CYP2C19RXRAPPARG
SCHEMBL3362205 0.82 POLB (0.39) POLBGABRA1GABRB2HTR1DHTR1B

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-117304226-A Synthesis method of ethyl bis (2, 4-di-tert-butyl-6-methylphenyl) phosphite 天津利安隆新材料股份有限公司 2023-12-29 CN disclosed