SCHEMBL1824971

SCHEMBL1824971

C1CCCC(N2CCOCC2)CC1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL3 Q96JM7 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HRH3 Q9Y5N1 4/20 0.44
PHGDH O43175 1/20 0.42
MGLL Q99685 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC18A3 Q16572 1/20 0.41
OPRL1 P41146 1/20 0.40
OGFRL1 Q5TC84 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL5709151 1.00 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL3L3MBTL1HRH3PHGDH
SCHEMBL35550 1.00 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL3L3MBTL1HRH3PHGDH
SCHEMBL1827648 0.97 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL3L3MBTL1HRH3PHGDH
Methylamine SCHEMBL28019730 0.93 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL3L3MBTL1HRH3PHGDH
SCHEMBL9425142 0.92 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL3L3MBTL1HRH3KDM4E
SCHEMBL25672747 0.91 L3MBTL3 (0.47) SMN1; SMN2L3MBTL3L3MBTL1HRH3KDM4E
SCHEMBL26025479 0.90 SMN1; SMN2 (0.48) SMN1; SMN2L3MBTL3L3MBTL1HRH3KDM4E
SCHEMBL14907095 0.88 L3MBTL3 (0.49) SMN1; SMN2L3MBTL3L3MBTL1HRH3KDM4E
SCHEMBL3168997 0.86
SCHEMBL26112782 0.86 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL3L3MBTL1HRH3MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118930764-A Photo-moisture curable urethane compound, photo-moisture curable urethane prepolymer, and photo-moisture curable resin composition 积水化学工业株式会社 2024-11-12 CN disclosed
CN-118930765-A Photo-moisture curable urethane compound, photo-moisture curable urethane prepolymer, and photo-moisture curable resin composition 积水化学工业株式会社 2024-11-12 CN disclosed
CN-113242869-B Photo-moisture curable urethane compound, photo-moisture curable urethane prepolymer, and photo-moisture curable resin composition 积水化学工业株式会社 2024-09-10 CN disclosed
CN-113242869-A Light-moisture-curable urethane compound, light-moisture-curable urethane prepolymer, and light-moisture-curable resin composition 积水化学工业株式会社 2021-08-10 CN disclosed
WO-2020129994-A1 LIGHT/MOISTURE-CURABLE URETHANE-BASED COMPOUND, LIGHT/MOISTURE-CURABLE URETHANE POLYMER, AND LIGHT/MOISTURE-CURABLE RESIN COMPOSITION 積水化学工業株式会社 2020-06-25 WO disclosed
US-20110183974-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS INSTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2011-07-28 US disclosed
EP-2318400-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS Istituto Di Ricerche Di Biologia Molecolare P. Angeletti S.P.A. (IT) 2011-05-11 EP disclosed
WO-2010013037-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2010-02-04 WO disclosed
US-20090054448-A1 Amino Acid Derivatives as Histone Deacetylase (HDAC) Inhibitors JONES PHILIP 2009-02-26 US disclosed
US-20080221157-A1 Amide Derivatives as Inhibitors of Histone Deacetylase ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGE (IT) 2008-09-11 US disclosed
EP-1945609-A2 AMINO ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2008-07-23 EP disclosed
EP-1768955-A1 AMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2007-04-04 EP disclosed
WO-2007029036-A2 AMINO ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2007-03-15 WO disclosed
WO-2006005941-A1 AMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI S.P.A. (IT) 2006-01-19 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 (3 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-20080221157-A1 Amide Derivatives as Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC4 SMN1; SMN2 1329/4885L3MBTL3 2394/4885L3MBTL1 2041/4885
US-20090054448-A1 Amino Acid Derivatives as Histone Deacetylase (HDAC) Inhibitors HDAC5, HDAC1, HDAC11 SMN1; SMN2 1280/4885L3MBTL3 3832/4885L3MBTL1 3032/4885
US-20110183974-A1 1,2,4-OXADIAZOLE SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS SMO ANTAGONISTS SHH, SMO, GLI1 SMN1; SMN2 518/4885L3MBTL3 4269/4885L3MBTL1 3642/4885

“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.