SCHEMBL8368333

SCHEMBL8368333

CNCC1CCCC(CNC)C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.41
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
NPC1 O15118 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.32
HTR2C P28335 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL24919619 0.91 SIGMAR1 (0.36) SIGMAR1ADH1BADH1CADH1AADH4
SCHEMBL8231944 0.89 CYP2D6 (0.36) SIGMAR1ADH1BADH1CADH1AADH4
SCHEMBL919776 0.88
SCHEMBL21948699 0.87 SIGMAR1 (0.47) SIGMAR1MAPT
SCHEMBL20630194 0.87 SIGMAR1 (0.34) SIGMAR1MEN1KMT2AHTR2C
Hydrochloric Acid SCHEMBL19556312 0.86
SCHEMBL20340832 0.85 SIGMAR1 (0.36) SIGMAR1ADH1BADH1CADH1AADH4
SCHEMBL8366602 0.85 SIGMAR1 (0.33) SIGMAR1
SCHEMBL23231226 0.84 SIGMAR1 (0.35) SIGMAR1ADH1BADH1CADH1AADH4
SCHEMBL25031323 0.84 SIGMAR1 (0.35) SIGMAR1ADH1BADH1CADH1AADH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113461543-B Rectification and purification method of 1, 3-cyclohexanediamine crude product 万华化学集团股份有限公司 2024-02-02 CN disclosed
WO-2023149394-A1 POLYMER, COMPOSITION, CURED PRODUCT, LAMINATED BODY, AND ELECTRONIC COMPONENT JSR株式会社 2023-08-10 WO disclosed
US-11256002-B2 Ophthalmic devices comprising photochromic materials with reactive substituents JOHNSON & JOHNSON VISION CARE, INC. (US) 2022-02-22 US disclosed
WO-2020148190-A1 HYDROXYURETHANE (METH)ACRYLATE PREPOLYMERS FOR USE IN 3D PRINTING BASF SE (DE) 2020-07-23 WO disclosed
EP-3680274-A1 HYDROXYURETHANE (METH)ACRYLATE PREPOLYMERS FOR USE IN 3D PRINTING BASF SE (DE) 2020-07-15 EP disclosed
US-20190129067-A1 OPHTHALMIC DEVICES COMPRISING PHOTOCHROMIC MATERIALS WITH REACTIVE SUBSTITUENTS JOHNSON & JOHNSON VISION CARE (US) 2019-05-02 US disclosed
EP-3278787-A1 POLYMERIZABLE MONOMER FOR DENTAL MATERIALS, COMPOSITION, ADHESIVE DENTAL MATERIAL, AND KIT Mitsui Chemicals, Inc. (JP) 2018-02-07 EP disclosed
US-8500265-B2 Ink jet ink, ink set, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2013-08-06 US disclosed
US-8123846-B2 Ink jet ink, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2012-02-28 US disclosed
US-20090274840-A1 INK JET INK, INK SET, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2009-11-05 US disclosed
US-20090238975-A1 INK JET INK, INK JET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT AND INK JET RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 2009-09-24 US disclosed
US-20070043095-A1 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use IPSEN PHARMA S.A.S. (FR) 2007-02-22 US disclosed
EP-0634524-B1 Paper coating composition SUMITOMO CHEMICAL CO (JP) 1999-01-13 EP disclosed
US-5654359-A INK RECEPTIVITY; WATERPROOFING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-05 US disclosed
EP-0634524-A1 Paper coating composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-18 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-20070043095-A1 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use SSTR2, SSTR5, SSTR3 SIGMAR1 216/4885ADH1B 1511/4885ADH1C 875/4885

“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.