SCHEMBL6278928

SCHEMBL6278928

CCCC1CCC(OC=O)CC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
CYP2C9 P11712 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
NAAA Q02083 1/20 0.31

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
SCHEMBL4159287 0.94 TLR4 (0.35) HPGDCYP2C9
SCHEMBL8735525 0.94 CYP1A2 (0.36) HPGDCYP2C9LMNAMAPTCYP1A2
SCHEMBL8013943 0.89 HPGD (0.35) HPGD
SCHEMBL1893345 0.88 CYP1A2 (0.47) HPGDCYP2C9LMNAMAPTCYP1A2
SCHEMBL504003 0.86 CYP1A2 (0.41) HPGDCYP2C9LMNAMAPTCYP1A2
SCHEMBL1896640 0.85 HTT (0.40) CYP2C9ALDH1A1LMNAMAPTCYP1A2
SCHEMBL8975284 0.85 HTT (0.40) CYP2C9ALDH1A1LMNAMAPTCYP1A2
SCHEMBL5862504 0.85 HTT (0.40) CYP2C9ALDH1A1LMNAMAPTCYP1A2
SCHEMBL11290481 0.85 HTT (0.40) CYP2C9ALDH1A1LMNAMAPTCYP1A2
SCHEMBL4170126 0.83 CYP1A2 (0.42) HPGDCYP2C9LMNAMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4348298-A WITH DICHROIC DYESTUFF VEB WERK FUR FERNSEHELEKTRONIK IM VEB KOMBINAT MIKROELEKTRONIK (DD) 1982-09-07 US claimed
US-9828338-B2 Carbamate derivatives of lactam based N-acylethanolamine acid amidase (NAAA) inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-28 US disclosed
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-03-10 US disclosed
WO-2015173168-A1 BENZOXAZOLONE DERIVATIVES AS ACID CERAMIDASE INHIBITORS, AND THEIR USE AS MEDICAMENTS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2015-11-19 WO disclosed
US-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP disclosed
EP-0688752-B1 Trifluoro-2-(trans-4-substituted cyclohexyl) ethylenes and process for their production ASAHI GLASS CO LTD (JP) 1999-01-13 EP disclosed
US-5621147-A LIQUID CRYSTAL INTERMEDIATES ASAHI GLASS COMPANY LTD. (JP) 1997-04-15 US disclosed
EP-0688752-A1 Trifluoro-2-(trans-4-substituted cyclohexyl) ethylenes and process for their production ASAHI GLASS COMPANY LTD. (JP) 1995-12-27 EP disclosed
EP-0413785-A1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS. MERCK PATENT GMBH (DE) 1991-02-27 EP disclosed
WO-1990009420-A1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-08-23 WO disclosed
US-4361494-A Anisotropic cyclohexyl cyclohexylmethyl ethers BBC BROWN, BOVERI, & COMPANY, LIMITED (CH) 1982-11-30 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 (2 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM HPGD 4399/4885CYP2C9 3509/4885ALDH1A1 2470/4885
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS NAAA, FAAH, FAAH2 HPGD 772/4885CYP2C9 1191/4885ALDH1A1 1195/4885

“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.