SCHEMBL28931111

SCHEMBL28931111

O=C(O)C(Cc1ccc([PH](=O)O)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 2/20 0.52
▸ MDM2 Q00987 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ SLC7A5 Q01650 2/20 0.40
▸ PTGS1 P23219 4/20 0.39
▸ PTGS2 P35354 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ AKR1C3 P42330 2/20 0.39
▸ CXCR1 P25024 2/20 0.39
▸ CXCR2 P25025 2/20 0.39
▸ ALB P02768 1/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ RARB P10826 1/20 0.39
▸ ADRB3 P13945 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ NR1I3 Q14994 1/20 0.39
▸ SLC22A6 Q4U2R8 1/20 0.39

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
SCHEMBL354216 0.83 SLC7A5 (0.62) CYP1A2SLC7A5PTGS1PTGS2LMNA
SCHEMBL30877184 0.82 LDHA (0.68) LDHAMDM2CYP1A2SLC7A5PTGS1
SCHEMBL65140 0.76 FFAR1 (0.59) LMNA
SCHEMBL3948311 0.75 CA2 (0.56) PTGS1LMNANFKB1TSHRBLM
SCHEMBL28390911 0.74 FFAR1 (0.57) LMNA
SCHEMBL28370869 0.74 FFAR1 (0.57) LMNA
SCHEMBL490650 0.74 SLC7A5 (0.67) LDHAMDM2SLC7A5ESR1
SCHEMBL392827 0.73 CYP1A2 (0.70) LDHAMDM2CYP1A2SLC7A5PTGS1
SCHEMBL21986448 0.73 CPA3 (0.41) SLC7A5PTGS1PTGS2LMNACYP2C9
SCHEMBL2515111 0.73 ESR1 (0.34) PTGS1PTGS2LMNACYP2C9AKR1C3

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-115558375-B Metal doped intumescent flame retardant coating liquid, flame retardant, preparation and application thereof 西华大学 2023-09-29 — — CN claimed
CN-115558375-A Metal-doped intumescent flame-retardant coating liquid, flame retardant, and preparation and application thereof 西华大学 2023-01-03 — — CN claimed
CN-115558375-A Metal-doped intumescent flame-retardant coating liquid, flame retardant, and preparation and application thereof 西华大学 2023-01-03 — — CN disclosed
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