SCHEMBL9596288

SCHEMBL9596288

O=C(O)CCCCCc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.52
▸ LMNA P02545 2/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ PMP22 Q01453 1/20 0.52
▸ F13A1 P00488 3/20 0.48
▸ MAPT P10636 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ SCD O00767 1/20 0.46
▸ GPR84 Q9NQS5 5/20 0.44
▸ FFAR1 O14842 2/20 0.44
▸ FFAR4 Q5NUL3 2/20 0.44
▸ PPARG P37231 6/20 0.43
▸ PPARD Q03181 6/20 0.43
▸ PPARA Q07869 6/20 0.43
▸ HDAC11 Q96DB2 5/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ TLR2 O60603 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ FABP4 P15090 2/20 0.43
▸ PTPN1 P18031 2/20 0.43

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
SCHEMBL2922043 0.91 LMNA (0.46) TSHRLMNANFKB1PMP22F13A1
SCHEMBL8812768 0.84 TSHR (0.67) TSHRLMNANFKB1PMP22F13A1
SCHEMBL30427829 0.82 F13A1 (0.48) TSHRLMNANFKB1PMP22F13A1
SCHEMBL2345633 0.81 FFAR1 (0.43) LMNAFFAR1FFAR4
SCHEMBL29009797 0.79 HDAC3 (0.39) TSHRLMNANFKB1PMP22F13A1
SCHEMBL29009970 0.79 HDAC3 (0.39) TSHRLMNANFKB1PMP22F13A1
SCHEMBL30831169 0.78 FAAH (0.54) MEN1KMT2AHSD17B10
Sebacic Acid SCHEMBL26976880 0.75 TSHR (0.92) TSHRLMNANFKB1PMP22GPR84
SCHEMBL29009918 0.75 HDAC3 (0.44) TSHRLMNAF13A1FFAR1FFAR4
SCHEMBL22160483 0.75 ALDH1A1 (0.41) TSHRLMNANFKB1PMP22SCD

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
WO-1993015047-A1 AMINO ACID DERIVATIVES AS PAF ANTAGONISTS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-08-05 — — WO disclosed
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