SCHEMBL3422768

SCHEMBL3422768

COC(=O)C(CS)NC(=O)c1ccccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.54
KDM4E B2RXH2 5/20 0.54
HPGD P15428 4/20 0.54
HSD17B10 Q99714 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TSHR P16473 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.45
GAA P10253 3/20 0.45
MPO P05164 1/20 0.45
HIF1A Q16665 1/20 0.45
ELANE P08246 2/20 0.43
ATM Q13315 1/20 0.43
KMT2A Q03164 3/20 0.43
FNTA P49354 2/20 0.43
FNTB P49356 2/20 0.43
PGGT1B P53609 1/20 0.43
RECQL P46063 1/20 0.42
TP53 P04637 3/20 0.42
HTT P42858 3/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL3422770 1.00 LMNA (0.54) LMNAKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL12308190 0.87 KMT2A (0.53) KDM4EALDH1A1GAAELANEKMT2A
SCHEMBL30059085 0.85 KDM4E (0.46) KDM4EHPGDHSD17B10ALDH1A1GAA
SCHEMBL17614815 0.85 KDM4E (0.56) LMNAKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL30600058 0.84 ALDH1A1 (0.51) KDM4EHPGDHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL2327455 0.84 CTSD (0.56) LMNAHPGDHSD17B10ALDH1A1TSHR
SCHEMBL2327457 0.84 CTSD (0.56) LMNAHPGDHSD17B10ALDH1A1TSHR
SCHEMBL17080362 0.84 ALDH1A1 (0.49) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL29104354 0.84 ALDH1A1 (0.51) KDM4EHPGDHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL12308265 0.84 FNTA (0.47) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9708245-B2 Fatty acid acylated salicylates and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2017-07-18 US disclosed
US-9708245-B2 Fatty acid acylated salicylates and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2017-07-18 US disclosed
US-9708245-B2 Fatty acid acylated salicylates and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2017-07-18 US disclosed
US-20160083336-A1 FATTY ACID ACYLATED SALICYLATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2016-03-24 US disclosed
US-20160083336-A1 FATTY ACID ACYLATED SALICYLATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2016-03-24 US disclosed
US-20160083336-A1 FATTY ACID ACYLATED SALICYLATES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2016-03-24 US disclosed
US-9085527-B2 Fatty acid acylated salicylates and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2015-07-21 US disclosed
US-9085527-B2 Fatty acid acylated salicylates and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2015-07-21 US disclosed
US-9085527-B2 Fatty acid acylated salicylates and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2015-07-21 US disclosed
US-8946451-B2 Lipoic acid acylated salicylate derivatives and their uses CATABASIS PHARMACEUTICALS, INC. (US) 2015-02-03 US disclosed
US-8846972-B2 2014-09-30 US disclosed
WO-2011044140-A1 SUBSTITUTED THIOACETIC ACID SALICYLATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2011-04-14 WO disclosed
WO-2011044138-A1 LIPOIC ACID ACYLATED SALICYLATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. (US) 2011-04-14 WO disclosed
US-20110082120-A1 SUBSTITUTED THIOACETIC ACID SALICYLATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2011-04-07 US disclosed
US-20110082120-A1 SUBSTITUTED THIOACETIC ACID SALICYLATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2011-04-07 US disclosed
US-20110082192-A1 LIPOIC ACID ACYLATED SALICYLATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2011-04-07 US disclosed
US-20110082192-A1 LIPOIC ACID ACYLATED SALICYLATE DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2011-04-07 US disclosed
US-20100184730-A1 Fatty Acid Acylated Salicylates and Their Uses CATABASIS PHARMACEUTICALS, INC. 2010-07-22 US disclosed
US-20100184730-A1 Fatty Acid Acylated Salicylates and Their Uses CATABASIS PHARMACEUTICALS, INC. 2010-07-22 US disclosed
US-20100184730-A1 Fatty Acid Acylated Salicylates and Their Uses CATABASIS PHARMACEUTICALS, INC. 2010-07-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110082120-A1 SUBSTITUTED THIOACETIC ACID SALICYLATE DERIVATIVES AND THEIR USES TST, SLC5A2, ACACA LMNA 4672/4885KDM4E 4030/4885HPGD 1097/4885
US-20110082192-A1 LIPOIC ACID ACYLATED SALICYLATE DERIVATIVES AND THEIR USES ACACA, ACAT2, ACACB LMNA 2301/4885KDM4E 2682/4885HPGD 407/4885
US-20160083336-A1 FATTY ACID ACYLATED SALICYLATES AND THEIR USES FADS1, FASN, ALOX5 LMNA 3266/4885KDM4E 3068/4885HPGD 338/4885
US-20100184730-A1 Fatty Acid Acylated Salicylates and Their Uses FADS1, FASN, ALOX5 LMNA 3266/4885KDM4E 3068/4885HPGD 338/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.