SCHEMBL22270810

SCHEMBL22270810

CC(C)(C)Oc1ccc(P(=O)(c2ccccc2)c2ccc(Oc3ccc(S(=O)(=O)c4ccc(C(C)(C)C)cc4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HSD11B1 P28845 4/20 0.41
▸ MMP2 P08253 4/20 0.38
▸ MMP9 P14780 3/20 0.38
▸ MMP8 P22894 3/20 0.38
▸ MMP12 P39900 3/20 0.38
▸ MMP13 P45452 3/20 0.38
▸ MMP14 P50281 3/20 0.38
▸ MMP16 P51512 3/20 0.38
▸ MMP3 P08254 2/20 0.38
▸ MAPT P10636 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ FDFT1 P37268 1/20 0.37
▸ LMNA P02545 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.36

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
SCHEMBL21030262 0.87 MAPT (0.44) SMN1; SMN2MAPTNPC1MAPK1RAB9A
SCHEMBL22373765 0.85 ALDH1A1 (0.49) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL18801598 0.85 ALDH1A1 (0.49) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL19738900 0.85 ALDH1A1 (0.49) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL19347627 0.85 ALDH1A1 (0.49) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL18801597 0.85 ALDH1A1 (0.49) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL18801809 0.85 ALDH1A1 (0.49) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL21653431 0.84 ALDH1A1 (0.45) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL18661775 0.84 ALDH1A1 (0.45) HTTSMN1; SMN2HSD11B1MAPTNPC1
SCHEMBL18801591 0.84 ALDH1A1 (0.45) HTTSMN1; SMN2HSD11B1MAPTNPC1

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-2762536-B1 Electrically conductive films formed from dispersions comprising polythiophenes and ether containing polymers SAMSUNG ELECTRONICS CO LTD (KR) 2020-07-29 — — EP disclosed
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