SCHEMBL25795079

SCHEMBL25795079

CCC(=O)CCCCCCCCCCOc1ccc(O)c(OC(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.41
▸ FFAR4 Q5NUL3 1/20 0.40
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC2 Q92769 2/20 0.39
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C8 P10632 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2B6 P20813 1/20 0.39
▸ CYP2C19 P33261 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
SCHEMBL25797693 0.88 APP (0.43) APPFFAR4HDAC1HDAC2
SCHEMBL25797920 0.85 APP (0.46) APPFFAR4
SCHEMBL25797846 0.85 APP (0.46) APPFFAR4
SCHEMBL25797612 0.84 NR5A1 (0.51) THRATHRB
SCHEMBL25797659 0.80 PDK2 (0.46) APPFFAR4
SCHEMBL25795071 0.79 APP (0.44) APPFFAR4HDAC1HDAC2
SCHEMBL25901757 0.79 APP (0.39) APPFFAR4
SCHEMBL8940652 0.77 L3MBTL1 (0.47) APP
SCHEMBL16363931 0.76 FFAR4 (0.47) FFAR4HDAC1HDAC2CYP2C9
SCHEMBL25797928 0.74 NR5A1 (0.42) FFAR4

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
EP-4194434-A1 POLYURETHANE, METHOD FOR PRODUCING POLYURETHANE, ELECTROCONDUCTIVE PASTE COMPOSITION, ELECTROCONDUCTIVE WIRE, AND METHOD FOR PRODUCING ELECTROCONDUCTIVE WIRE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-06-14 — — EP disclosed
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