SCHEMBL10428376

SCHEMBL10428376

CC(C)(C)c1cc(C(=O)c2ccccc2F)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.61
▸ POLB P06746 1/20 0.61
▸ HSP90AA1 P07900 7/20 0.50
▸ HSP90AB1 P08238 7/20 0.50
▸ ABCC9 O60706 1/20 0.47
▸ ABCC8 Q09428 1/20 0.47
▸ KCNJ11 Q14654 1/20 0.47
▸ KCNJ8 Q15842 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ GMNN O75496 1/20 0.47
▸ TTR P02766 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ HPGD P15428 1/20 0.47

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
SCHEMBL29405270 0.85 ALOX5 (0.55) MAPTPOLBABCC9ABCC8KCNJ11
SCHEMBL10428298 0.84 SMN1; SMN2 (0.51) MAPTPOLBHSP90AA1HSP90AB1ALDH1A1
SCHEMBL10428429 0.80 H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 (0.53) MAPTPOLBHSP90AA1HSP90AB1RARB
SCHEMBL10428264 0.80 HSP90AA1 (0.56) HSP90AA1HSP90AB1ABCC9ABCC8KCNJ11
SCHEMBL11529248 0.79 ALDH1A1 (0.54) MAPTPOLBABCC9ABCC8KCNJ11
SCHEMBL10428425 0.78 SIRT1 (0.54) MAPTPOLBHSP90AA1HSP90AB1ABCC9
SCHEMBL2786142 0.77 ALDH1A1 (0.50) MAPTABCC9ABCC8KCNJ11KCNJ8
SCHEMBL15197122 0.77 ALDH1A1 (0.54) MAPTABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7367690 0.77 SLC22A6 (0.66) MAPTPOLBHSP90AA1HSP90AB1ALDH1A1
SCHEMBL10428380 0.76 RARB (0.58) HSP90AA1HSP90AB1ALDH1A1LMNACYP2C9

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-4927835-A ANTIPYRETICS NIPPON SHINYAKU CO., LTD. (JP) 1990-05-22 — — US disclosed
EP-0331195-A2 Acylphenol derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1989-09-06 — — EP disclosed
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