SCHEMBL27418397

SCHEMBL27418397

Cc1ccc(Oc2cccc(P(=O)(O)O)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.45
▸ HSD17B1 P14061 2/20 0.44
▸ HSD17B2 P37059 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ GFER P55789 1/20 0.44
▸ MMP13 P45452 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GCK P35557 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.43
▸ PNLIP P16233 1/20 0.42
▸ FFAR1 O14842 2/20 0.42
▸ LMNA P02545 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL27395625 0.88 ALDH1A1 (0.50) HTTL3MBTL1TDP1ALDH1A1HSD17B1
SCHEMBL10849592 0.86 CA2 (0.56) L3MBTL1TDP1ALDH1A1TSHRNPC1
Phosphoric Acid SCHEMBL9308118 0.86 HTT (0.56) HTTL3MBTL1TDP1ALDH1A1HSD17B1
SCHEMBL27396334 0.83 ALDH1A1 (0.57) HTTL3MBTL1TDP1ALDH1A1HSD17B1
SCHEMBL27395622 0.82 TSHR (0.56) HTTL3MBTL1TDP1ALDH1A1MAPK1
SCHEMBL27430217 0.80 MEN1 (0.47) HTTL3MBTL1TDP1SMN1; SMN2LMNA
SCHEMBL9309014 0.80 SRC (0.50) HTTL3MBTL1TDP1ALDH1A1HSD17B1
Phosphoric Acid SCHEMBL5518515 0.78 HTT (0.61) HTTMMP13SMN1; SMN2PNLIPFFAR1
SCHEMBL83816 0.78 TDP1 (0.61) HTTL3MBTL1TDP1ALDH1A1GFER
SCHEMBL27418971 0.78 GCK (0.45) L3MBTL1ALDH1A1SMN1; SMN2GCKFFAR1

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-1089614-A Alpha-phosphonosulfonate squalene synthetase inhibitors and method SQUIBB & SONS INC (US) 1994-07-20 — — CN disclosed
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