SCHEMBL28765799

SCHEMBL28765799

Cc1ccc(OOP(=O)(O)O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ USP2 O75604 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TYR P14679 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ HPGD P15428 2/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ MRGPRX4 Q96LA9 1/20 0.34
▸ PTPN1 P18031 1/20 0.33
▸ ACHE P22303 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ TP53 P04637 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ SCN9A Q15858 1/20 0.32
▸ PTGS1 P23219 1/20 0.32

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
SCHEMBL4650194 0.84 APEX1 (0.39) MEN1KMT2AALDH1A1CA2HPGD
SCHEMBL2869215 0.83 INPPL1 (0.46) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL28946510 0.82 INPPL1 (0.44) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL27455100 0.82 INPPL1 (0.44) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL27341251 0.82 INPPL1 (0.44) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL27433045 0.82 INPPL1 (0.44) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL27354525 0.82 INPPL1 (0.44) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL27467153 0.81 INPPL1 (0.43) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL5085354 0.80 MEN1 (0.39) MEN1KMT2AUSP2ALDH1A1CA2
SCHEMBL1487458 0.76 CYP3A4 (0.44) MEN1KMT2AUSP2ALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113896745-A Continuous preparation method of substituted diaryl phosphate compound 华东理工大学 2022-01-07 — — CN disclosed
CN-100526319-C Organic phosphate rare earth salt nucleater, synthesis method and application thereof GUANGDONG HUANAN FINE CHEMICAL (CN) 2009-08-12 — — CN disclosed
CN-101054387-A Organic phosphate rare earth salt nucleater, synthesis method and application thereof GUANGDONG HUANAN FINE CHEMICAL (CN) 2007-10-17 — — CN disclosed
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