SCHEMBL11555907

SCHEMBL11555907

CC(C)(C)c1ccc(O)c(Sc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.50
▸ GAA P10253 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ PKM P14618 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CYP2D6 P10635 2/20 0.46
▸ ESR1 P03372 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ TP53 P04637 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HDAC4 P56524 1/20 0.40

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
SCHEMBL496753 0.85 ALDH1A1 (0.61) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL11764161 0.83 HSD17B2 (0.49) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL20022733 0.79 HTR1A (0.39) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL23598230 0.78 MAPT (0.40) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL15195988 0.77 ALDH1A1 (0.61) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL7568805 0.77 ESR1 (0.55) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL31222343 0.77 ALOX15 (0.70) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL22991116 0.76 PDE7A (0.50) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL9643594 0.76 ALDH1A1 (0.59) MAPTGAAMEN1KMT2AALDH1A1
SCHEMBL2861898 0.76 HPGD (0.44) MAPTGAAMEN1KMT2AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4143076-A MERCAPTO PHENOLIC AND ALKYLTHIO PHENOLIC ANTIOXIDANTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1979-03-06 — — US disclosed
US-4128530-A Mercapto phenolic and alkylthio phenolic antioxidants THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-12-05 — — US disclosed
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