SCHEMBL2143307

SCHEMBL2143307

C=CCOB(O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.40
ORAI1 Q96D31 3/20 0.39
ORAI2 Q96SN7 3/20 0.39
ORAI3 Q9BRQ5 3/20 0.39
TRPV6 Q9H1D0 3/20 0.39
PCSK9 Q8NBP7 2/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
ENPP2 Q13822 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
TSHR P16473 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 2/20 0.35
MAPK1 P28482 2/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL28821752 0.81 CYP3A4 (0.38) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL11904863 0.80 ORAI1 (0.39) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL28545103 0.80 ORAI1 (0.39) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL2143304 0.79 CYP3A4 (0.38) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL9941405 0.77 TRPV6 (0.37) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL9941370 0.74 AKT1 (0.40) ORAI1ORAI2ORAI3TRPV6PCSK9
SCHEMBL363448 0.74 TRPV6 (0.46) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL7568394 0.73 CYP3A4 (0.38) CYP3A4TSHRALDH1A1HSD17B10HPGD
SCHEMBL1129435 0.72 TRPV6 (0.44) CYP3A4ORAI1ORAI2ORAI3TRPV6
SCHEMBL1660275 0.72 TRPV6 (0.44) CYP3A4ORAI1ORAI2ORAI3TRPV6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116426295-A Preparation method of side fluorine-containing terphenyl liquid crystal monomer 河北凡克新材料有限公司 2023-07-14 CN claimed
CN-112898133-B Preparation method of trans-ketone intermediate 河北迈尔斯通电子材料有限公司 2022-11-15 CN claimed
CN-112850685-B Two-dimensional carbon material and preparation method and application thereof 厦门稀土材料研究所 2022-10-18 CN claimed
CN-113278094-B Cyclodextrin derivative and preparation method and application thereof 兰州大学 2022-03-01 CN claimed
CN-113278094-A Cyclodextrin derivative and preparation method and application thereof 兰州大学 2021-08-20 CN claimed
CN-108753312-B Liquid crystal compound, preparation method thereof, composition containing liquid crystal compound and high-frequency component containing liquid crystal medium 西安近代化学研究所 2021-07-27 CN claimed
CN-112898133-A Preparation method of trans-ketone intermediate 河北迈尔斯通电子材料有限公司 2021-06-04 CN claimed
CN-117865773-A Preparation method of difluoromethyl aromatic compound based on palladium-catalyzed decarbonylation coupling 大连理工大学 2024-04-12 CN disclosed
CN-116426295-A Preparation method of side fluorine-containing terphenyl liquid crystal monomer 河北凡克新材料有限公司 2023-07-14 CN disclosed
CN-112898133-B Preparation method of trans-ketone intermediate 河北迈尔斯通电子材料有限公司 2022-11-15 CN disclosed
CN-112850685-B Two-dimensional carbon material and preparation method and application thereof 厦门稀土材料研究所 2022-10-18 CN disclosed
CN-113278094-B Cyclodextrin derivative and preparation method and application thereof 兰州大学 2022-03-01 CN disclosed
CN-113278094-A Cyclodextrin derivative and preparation method and application thereof 兰州大学 2021-08-20 CN disclosed
US-20080293768-A1 Novel Compounds Derived From 5-Thioxylose And Their Use In Therapeutics INVENTIVA (FR) 2008-11-27 US disclosed
EP-1414955-B1 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION PERKINELMER LIFE SCIENCES INC (US) 2008-08-20 EP disclosed
EP-1414955-A4 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION PERKINELMER LIFE SCIENCES INC (US) 2004-10-06 EP disclosed
EP-1414955-A2 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION Perkinelmer Life Sciences, Inc. (US) 2004-05-06 EP disclosed
US-6617125-B2 Reacting conjugate comprising detectably labeled phenol-containing molecule with peroxidase enzyme; for detection of cytomegalovirus using cyanide-3 tyramide enhanced with 4-thioanisole boronic acid PERKINELMER LIFE SCIENCES, INC. 2003-09-09 US disclosed
US-20030017460-A1 Compositions for enhanced catalyzed reporter deposition PERKINELMER LIFE SCIENCES, INC. 2003-01-23 US disclosed
WO-2003002733-A2 COMPOSITIONS FOR ENHANCED CATALYZED REPORTER DEPOSITION PERKINELMER LIFE SCIENCES, INC. (US) 2003-01-09 WO 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-20080293768-A1 Novel Compounds Derived From 5-Thioxylose And Their Use In Therapeutics TPMT, STS, TBXAS1 CYP3A4 256/4885ORAI1 4387/4885ORAI2 4583/4885

“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.