SCHEMBL4815133

SCHEMBL4815133

CC1CCC(C(C)C)[C](C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 1/20 0.35
EPHX1 P07099 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TRPM8 Q7Z2W7 3/20 0.31
TRPA1 O75762 2/20 0.31
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
NR4A1 P22736 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL7731793 0.85 EPHX1 (0.37) NPC1L3MBTL1EPHX1KMT2AMEN1
SCHEMBL11291779 0.80 ALDH1A1 (0.35) NPC1L3MBTL1EPHX1KMT2AMEN1
SCHEMBL4379358 0.78 NPC1 (0.35) NPC1L3MBTL1ALDH1A1
Menthone SCHEMBL28849343 0.76 NPC1 (0.42) NPC1L3MBTL1USP2EPHX1KMT2A
Menthone SCHEMBL31534032 0.76 NPC1 (0.42) NPC1L3MBTL1USP2EPHX1KMT2A
Rel-Menthone SCHEMBL9996907 0.73 NPC1 (0.40) NPC1L3MBTL1USP2EPHX1KDM4E
Menthone SCHEMBL9996908 0.73 NPC1 (0.40) NPC1L3MBTL1USP2EPHX1KDM4E
SCHEMBL4258104 0.73 NPC1 (0.37) NPC1L3MBTL1EPHX1KMT2AMEN1
SCHEMBL1697828 0.73 TRPA1 (0.35) NPC1L3MBTL1EPHX1TRPM8TRPA1
Menthone SCHEMBL21709 0.71 TLR4 (0.39) NPC1L3MBTL1TRPM8TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390762-B2 Method for the preparation of high-content NaY molecular sieves synthesized from kaolin sprayed microspheres PETROCHINA COMPANY LIMITED (CN) 2008-06-24 US claimed
US-20060116277-A1 Method for the preparation of high-content NaY molecular sieves synthesized from kaolin sprayed microspheres PETROCHINA COMPANY LIMITED 2006-06-01 US claimed
EP-3541359-B1 TABLET COMPRISING SEPARATE BINDER AND ERYTHRITOL FERTIN PHARMA AS (DK) 2021-01-27 EP disclosed
US-10632076-B2 Tablet comprising separate binder and erythritol FERTIN PHARMA A/S (DK) 2020-04-28 US disclosed
US-20200078308-A1 TABLET COMPRISING SEPARATE BINDER AND ERYTHRITOL FERTIN PHARMA A/S (DK) 2020-03-12 US disclosed
EP-3541359-A1 TABLET COMPRISING SEPARATE BINDER AND ERYTHRITOL Fertin Pharma A/S (DK) 2019-09-25 EP disclosed
WO-2018091050-A1 TABLET COMPRISING SEPARATE BINDER AND ERYTHRITOL FERTIN PHARMA A/S (DK) 2018-05-24 WO disclosed
US-20180140554-A1 TABLET COMPRISING SEPARATE BINDER AND ERYTHRITOL FERTIN PHARMA A/S (DK) 2018-05-24 US disclosed
WO-2013007135-A1 EASILY ERASABLE HYDROLYTIC FADING INK AND PREPARATION METHOD THEREOF 宁波绿拓新材料有限公司 (CN) 2013-01-17 WO disclosed
CN-101446055-B Matt color ink jet printer paper paint and preparation method thereof UNIV JIANGNAN 2010-08-25 CN disclosed
CN-101446055-A Matt color ink jet printer paper paint and preparation method thereof UNIV JIANGNAN (CN) 2009-06-03 CN disclosed
US-20060116277-A1 Method for the preparation of high-content NaY molecular sieves synthesized from kaolin sprayed microspheres PETROCHINA COMPANY LIMITED 2006-06-01 US disclosed
US-20060116277-A1 Method for the preparation of high-content NaY molecular sieves synthesized from kaolin sprayed microspheres PETROCHINA COMPANY LIMITED 2006-06-01 US disclosed
WO-2006011046-A1 FORMULATION FOR STIMULATING HAIR GROWTH WARNER-LAMBERT COMPANY LLC (US) 2006-02-02 WO disclosed
CN-1557792-A Granulated guano phosphate fertilizer 黄雄强 2004-12-29 CN disclosed
US-20030027787-A1 Crosslinked polysaccharide, obtained by crosslinking with substituted polyethylene glycol, as superabsorbant GROUP LYSAC INC./LYSAC GROUP INC. 2003-02-06 US disclosed
CN-1391803-A Rubber production promoter for rubber trees RUBBER CULTIVATION INST CHINA (CN) 2003-01-22 CN disclosed
CN-1391805-A Rice coating agent and its preparing method KUMING CITY AGRICULTURE TECHNO (CN) 2003-01-22 CN disclosed
CN-1332058-A Welding rod resulting in high fatigue strength of welded joint UNIV TIANJIN (CN) 2002-01-23 CN disclosed
US-5059614-A NOVEL ISOXAZOLE AND ISOXAZOLINE COMPOUNDS WITH ANTICONVULSANT ACTIVITY PROCESS FOR THEIR PREPARATION AND THERAPEUTIC COMPOSITION CONTAINING THEM NOVAPHARME (FR) 1991-10-22 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 (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-20030027787-A1 Crosslinked polysaccharide, obtained by crosslinking with substituted polyethylene glycol, as superabsorbant CLTB, SI, CLTA NPC1 3471/4885L3MBTL1 1726/4885USP2 424/4885

“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.