SCHEMBL1641497

SCHEMBL1641497

CC(SCc1ccco1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
ALDH1A1 P00352 8/20 0.44
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 3/20 0.42
MAPT P10636 2/20 0.41
HSD17B10 Q99714 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 2/20 0.41
PKM P14618 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN7 P35236 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 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
SCHEMBL7589709 0.87 ALDH1A1 (0.47) TSHRALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL25385377 0.85 TSHR (0.47) TSHRPTGS1PTGS2ALDH1A1SLC1A3
SCHEMBL7592515 0.84 TSHR (0.42) TSHRALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL14861563 0.83 ALDH1A1 (0.53) TSHRALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL10528046 0.81 TSHR (0.46) TSHRPTGS1PTGS2ALDH1A1SLC1A3
SCHEMBL1532559 0.78 ALDH1A1 (0.42) TSHRALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3504630 0.78 ALDH1A1 (0.45) TSHRALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL28694773 0.78 TSHR (0.52) TSHRPTGS1PTGS2ALDH1A1SLC1A3
SCHEMBL28568509 0.78 POLB (0.58) TSHRALDH1A1SLC1A3SLC1A2SLC1A1
SCHEMBL5870236 0.77 TSHR (0.43) TSHRPTGS1PTGS2ALDH1A1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3368542-A2 HIGH INTENSITY SWEETENERS Senomyx, Inc. (US) 2018-09-05 EP disclosed
US-9890351-B2 Encapsulates THE PROCTER & GAMBLE COMPANY (US) 2018-02-13 US disclosed
WO-2017075257-A2 HIGH INTENSITY SWEETENERS SENOMYX, INC. (US) 2017-05-04 WO disclosed
US-8889614-B2 Encapsulates THE PROCTER & GAMBLE COMPANY (US) 2014-11-18 US disclosed
EP-2741731-A1 ENCAPSULATES The Procter and Gamble Company (US) 2014-06-18 EP disclosed
US-20130039962-A1 ENCAPSULATES ENCAPSYS, LLC 2013-02-14 US disclosed
WO-2013022949-A1 ENCAPSULATES THE PROCTER & GAMBLE COMPANY (US) 2013-02-14 WO disclosed
WO-2012085864-A1 ENCAPSULATES PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) 2012-06-28 WO disclosed
US-20120152268-A1 ENCAPSULATES PROCTER & GAMBLE COMPANY, THE 2012-06-21 US disclosed
US-20110105378-A1 ENCAPSULATES SMETS JOHAN 2011-05-05 US disclosed
US-20110098209-A1 ENCAPSULATES SMETS JOHAN 2011-04-28 US disclosed
US-20100190673-A1 ENCAPSULATES THE PROCTER & GAMBLE COMPANY 2010-07-29 US disclosed
US-20100190674-A1 ENCAPSULATES PROCTER & GAMBLE COMPANY, THE 2010-07-29 US disclosed
WO-1997026926-A1 AIR FRESHENER COMPOSITION CONTAINING A FIBER PAD EASTMAN CHEMICAL COMPANY (US) 1997-07-31 WO disclosed
US-4837316-A ANTIULCER AGENTS FUJIREBIO KABUSHIKI KAISHA (JP) 1989-06-06 US disclosed
EP-0214823-A2 Alkylamide derivatives with H2-receptor antagonistic and cytoprotective action FUJIREBIO KABUSHIKI KAISHA also trading as FUJIREBIO INC. (JP) 1987-03-18 EP 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 (1 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-20130039962-A1 ENCAPSULATES ABCB4, PPIB, FLNB TSHR 4882/4885PTGS1 3500/4885PTGS2 3014/4885

“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.