SCHEMBL108105

SCHEMBL108105

[CH2]CC(CCCCC)C1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.35
CYP1A2 P05177 1/20 0.34
OPRM1 P35372 1/20 0.32
TSHR P16473 1/20 0.32
EPHX1 P07099 2/20 0.32
SIGMAR1 Q99720 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL1524594 0.98 SHBG (0.39) SHBGCYP1A2TSHREPHX1SIGMAR1
SCHEMBL9207424 0.98 SHBG (0.34) SHBGTSHREPHX1SIGMAR1
SCHEMBL9204484 0.98 SHBG (0.34) SHBGTSHREPHX1SIGMAR1
SCHEMBL10472499 0.96 SHBG (0.38) SHBGCYP1A2TSHREPHX1SIGMAR1
SCHEMBL9210781 0.96 SHBG (0.38) SHBGCYP1A2TSHREPHX1SIGMAR1
SCHEMBL9209181 0.96 SHBG (0.38) SHBGCYP1A2TSHREPHX1SIGMAR1
SCHEMBL9205067 0.94 SHBG (0.37) SHBGCYP1A2SIGMAR1
SCHEMBL1524470 0.90 LMNA (0.35) OPRM1TSHR
SCHEMBL11677040 0.85 SHBG (0.44) SHBGCYP1A2TSHREPHX1SIGMAR1
SCHEMBL29322013 0.85 SHBG (0.39) SHBGCYP1A2TSHREPHX1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109883-A1 Anti-Tumor Compositions and Methods EVRYS BIO, LLC (US) 2024-04-04 US disclosed
US-20230416241-A1 Broad Spectrum Antiviral Compositions and Methods EVRYS BIO, LLC (US) 2023-12-28 US disclosed
US-11459321-B2 Broad spectrum antiviral compositions and methods EVRYS BIO, LLC (US) 2022-10-04 US disclosed
US-11358961-B2 Anti-HCMV compositions and methods EVRYS BIO, LLC (US) 2022-06-14 US disclosed
US-20220135556-A1 ANTI-HCMV COMPOSITIONS AND METHODS EVRYS BIO, LLC (US) 2022-05-05 US disclosed
EP-2763533-B1 TRIAZOLYL PDE10 INHIBITORS MERCK SHARP & DOHME (US) 2021-12-29 EP disclosed
CN-105777776-B Inhibitors of protein tyrosine kinase activity 梅特希尔基因公司 2021-06-08 CN disclosed
US-20210139475-A1 Broad Spectrum Antiviral Compositions and Methods EVRYS BIO, LLC (US) 2021-05-13 US disclosed
US-20210040049-A1 ANTI-HCMV COMPOSITIONS AND METHODS EVRYS BIO, LLC (US) 2021-02-11 US disclosed
EP-2542076-B1 INHIBITORS OF CATECHOL O-METHYL TRANSFERASE AND THEIR USE IN THE TREATMENT OF PSYCHOTIC DISORDERS MERCK SHARP & DOHME (US) 2021-01-13 EP disclosed
WO-2004048393-A2 NOVEL INHIBITORS OF β-LACTAMASE METHYLGENE, INC. (CA) 2004-06-10 WO disclosed
US-20040106599-A1 Inhibitors of histone deacetylase 92229129 QUEBEC INC. (CA) 2004-06-03 US disclosed
WO-2004043955-A1 RHODANINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RIGEL PHARMACEUTICALS, INC. (US) 2004-05-27 WO disclosed
US-20040082546-A1 Novel Inhibitors of beta-lactamase METHYLGENE, INC. 2004-04-29 US disclosed
WO-2004035571-A1 SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2004-04-29 WO disclosed
WO-2004035525-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2004-04-29 WO disclosed
US-20040029836-A1 Novel inhibitors of beta-lactamase 92229129 QUEBEC INC. (CA) 2004-02-12 US disclosed
US-20030225112-A1 Inhibitors to tubulin polymerization RIGEL PHARMACEUTICALS, INC. 2003-12-04 US disclosed
WO-2003070241-A1 INHIBITORS OF TUBULIN POLYMERIZATION RIGEL PHARMACEUTICALS, INC. (US) 2003-08-28 WO disclosed
WO-2003024448-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2003-03-27 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 (11 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-20230416241-A1 Broad Spectrum Antiviral Compositions and Methods IRF3, MAVS, ZC3HAV1 SHBG 4373/4885CYP1A2 3233/4885OPRM1 4832/4885
US-11459321-B2 Broad spectrum antiviral compositions and methods IRF3, MAVS, ZC3HAV1 SHBG 4373/4885CYP1A2 3233/4885OPRM1 4832/4885
US-11358961-B2 Anti-HCMV compositions and methods RPL35, RPL7, RPL5 SHBG 3533/4885CYP1A2 4826/4885OPRM1 4843/4885
US-20040106599-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 SHBG 4421/4885CYP1A2 4430/4885OPRM1 4869/4885
US-20030225112-A1 Inhibitors to tubulin polymerization TUBB3, TUBB1, TUBB SHBG 4467/4885CYP1A2 4057/4885OPRM1 4843/4885
US-20040029836-A1 Novel inhibitors of beta-lactamase LSS, MGAM, COASY SHBG 1462/4885CYP1A2 224/4885OPRM1 2020/4885
US-20240109883-A1 Anti-Tumor Compositions and Methods DDX5, IRF3, TP53 SHBG 3510/4885CYP1A2 4146/4885OPRM1 4412/4885
US-20210040049-A1 ANTI-HCMV COMPOSITIONS AND METHODS RPL35, RPL7, RPL5 SHBG 2036/4885CYP1A2 4785/4885OPRM1 4775/4885
US-20210139475-A1 Broad Spectrum Antiviral Compositions and Methods MAVS, IRF3, ZC3HAV1 SHBG 4317/4885CYP1A2 3882/4885OPRM1 4558/4885
US-20220135556-A1 ANTI-HCMV COMPOSITIONS AND METHODS RPL35, RPL7, RPL5 SHBG 3533/4885CYP1A2 4826/4885OPRM1 4843/4885
US-20040082546-A1 Novel Inhibitors of beta-lactamase LSS, MGAM, COASY SHBG 1450/4885CYP1A2 167/4885OPRM1 2131/4885

“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.