SCHEMBL584831

SCHEMBL584831

CC1CCC(C(C)C)C(OC(N)=O)C1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.58
ALDH1A1 P00352 9/20 0.57
HPGD P15428 2/20 0.57
CYP19A1 P11511 2/20 0.52
TRPA1 O75762 2/20 0.47
TRPM8 Q7Z2W7 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 2/20 0.45
USP2 O75604 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL27914203 1.00 EPHX1 (0.58) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL5495940 1.00 EPHX1 (0.58) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL10199136 1.00 EPHX1 (0.58) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL2125537 1.00 EPHX1 (0.58) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL3380308 0.90 EPHX1 (0.53) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL24026949 0.90 EPHX1 (0.49) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL18629605 0.90 EPHX1 (0.49) EPHX1ALDH1A1HPGDCYP19A1TRPA1
Nornitrogen Mustard SCHEMBL3380310 0.87 EPHX1 (0.51) EPHX1ALDH1A1HPGDCYP19A1TRPM8
SCHEMBL13468949 0.87 ALDH1A1 (0.58) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL28062170 0.87 ALDH1A1 (0.58) EPHX1ALDH1A1HPGDCYP19A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103002868-B As the carbamic acid cyclohexyl compound of active fat melting composition SYMRISE AG (DE) 2016-05-04 CN claimed
CN-103025310-B Cyclohexyl carbamate compounds as skin and/or hair lightening actives SYMRISE AG (DE) 2016-01-27 CN claimed
CN-101679278-B Process for the preparation of dibenzo [B,D]azepin-6-one derivative HOFFMANN LA ROCHE 2013-08-14 CN claimed
EP-2164830-B1 PROCESS FOR THE PREPARATION OF DIBENZO [B,D]AZEPIN-6-ONE DERIVATIVE HOFFMANN LA ROCHE (CH) 2013-05-29 EP claimed
CN-103025310-A Cyclohexyl carbamate compounds as skin and/or hair lightening actives SYMRISE GMBH & CO KG 2013-04-03 CN claimed
CN-103002868-A Cyclohexyl carbamate compounds as active anti-cellulite ingredients SYMRISE GMBH & CO KG 2013-03-27 CN claimed
EP-2164830-A2 PROCESS FOR THE PREPARATION OF DIBENZO [B,D]AZEPIN-6-ONE DERIVATIVE F. Hoffmann-Roche AG (CH) 2010-03-24 EP claimed
CN-101679278-A Process for the preparation of dibenzo [B, D] aza-6-one derivatives HOFFMANN LA ROCHE 2010-03-24 CN claimed
US-7579464-B2 Process for preparation of enantiomerically pure compounds HOFFMANN-LA ROCHE INC. (US) 2009-08-25 US claimed
WO-2008145525-A2 PROCESS FOR THE PREPARATION OF DIBENZO [B,D]AZEPIN-6-ONE DERIVATIVE F. HOFFMANN-LA ROCHE AG (CH) 2008-12-04 WO claimed
US-20080293933-A1 PROCESS FOR PREPARATION OF ENANTIOMERICALLY PURE COMPOUNDS HOFFMANN-LA ROCHE, INC. 2008-11-27 US claimed
US-20220117881-A1 A HAIR CARE COMPOSITION SYMRISE AG (DE) 2022-04-21 US disclosed
CN-113730292-A Whitening essence and preparation method and application thereof 深圳市靓丽人生化妆品有限公司 2021-12-03 CN disclosed
CN-113226267-A Hair care composition 西姆莱斯股份公司 2021-08-06 CN disclosed
EP-3849505-A1 A HAIR CARE COMPOSITION Symrise AG (DE) 2021-07-21 EP disclosed
US-5229381-A Inhibitors of leukocyte enzyme elastase MERCK & CO., INC. (US) 1993-07-20 US disclosed
US-5180736-A Treatment and prevention of brain disorders WARNER-LAMBERT COMPANY (US) 1993-01-19 US disclosed
EP-0481671-A1 New substituted azetidinones as anti-inflammatory and antidegenerative agents MERCK & CO. INC. (US) 1992-04-22 EP disclosed
US-5071853-A Amine-substituted hexahydroindeno(2,1-b)pyrroles, -indeno(2,1-c)pyridines or -indeno(2,1-d)azepines; cerebral ischemia or infarction WARNER-LAMBERT COMPANY 1991-12-10 US disclosed
EP-0388977-A2 Polycyclic amines useful as cerebrovascular agents WARNER-LAMBERT COMPANY (US) 1990-09-26 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-20080293933-A1 PROCESS FOR PREPARATION OF ENANTIOMERICALLY PURE COMPOUNDS BACE1, BACE2, BCHE EPHX1 504/4885ALDH1A1 923/4885HPGD 1698/4885

“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.