SCHEMBL330974

SCHEMBL330974

O=C=NC1(N=C=O)C=CC(CCc2ccccc2)C=C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
FASN P49327 1/20 0.33
TRPA1 O75762 1/20 0.32
CYP2E1 P05181 1/20 0.32
CYP2A6 P11509 1/20 0.32
MIF P14174 1/20 0.32
CYP2A13 Q16696 1/20 0.32
EPAS1 Q99814 1/20 0.32
SLC1A2 P43004 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
BRCA1 P38398 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
CUL4A Q13619 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
SCHEMBL27437866 0.68 ALDH1A1 (0.42) CYP2A6ALDH1A1HPGDALOX15SMN1; SMN2
SCHEMBL8469335 0.67 HTT (0.35) MAPTMEN1ALDH1A1HPGDALOX15
SCHEMBL27275720 0.65 ALDH1A1 (0.39) CYP2A6ALDH1A1HPGDALOX15SMN1; SMN2
SCHEMBL2059225 0.61 CYP1A2 (0.41) HIF1AMAPTTRPA1CYP2E1CYP2A6
Phenethyl Isocyanate SCHEMBL5918 0.60 MIF (0.63) HIF1AMAPTTRPA1CYP2E1CYP2A6
SCHEMBL7604988 0.58 MAOA (0.50) CYP2A6ALDH1A1HPGDALOX15SMN1; SMN2
SCHEMBL43326 0.58 MAOA (0.50) CYP2A6ALDH1A1HPGDALOX15SMN1; SMN2
SCHEMBL11344362 0.58 MAOA (0.50) CYP2A6ALDH1A1HPGDALOX15SMN1; SMN2
SCHEMBL20955661 0.58
SCHEMBL4600058 0.58 CYP3A4 (0.63) HIF1ATRPA1CYP2E1CYP2A6MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3539998-A1 METHOD FOR MANUFACTURING RESIN FOR URETHANE-BASED OPTICAL MATERIAL, RESIN COMPOSITION FOR SAME, AND OPTICAL MATERIAL MANUFACTURED THEREBY Koc Solution Co.,LTD. (KR) 2019-09-18 EP claimed
EP-2682430-B2 METHOD FOR MANUFACTURING RESIN FOR THIOURETHANE-BASED OPTICAL MATERIAL USING UNIVERSAL POLYISOCYANATE COMPOUND, RESIN COMPOSITION, AND OPTICAL MATERIAL MANUFACTURED THEREBY KOC SOLUTION CO LTD (KR) 2019-07-17 EP claimed
US-10067266-B2 Method of producing resin for thiourethane-based optical material using general-purpose polyisocyanate compound, resin composition for thiourethane-based optical material and thiourethane-based optical material including resin produced by the method KOC SOLUTION CO., LTD. (KR) 2018-09-04 US claimed
EP-2682430-B1 METHOD FOR MANUFACTURING RESIN FOR THIOURETHANE-BASED OPTICAL MATERIAL USING UNIVERSAL POLYISOCYANATE COMPOUND, RESIN COMPOSITION, AND OPTICAL MATERIAL MANUFACTURED THEREBY KOC SOLUTION CO LTD (KR) 2015-10-21 EP claimed
US-20150226879-A1 METHOD OF MANUFACTURING THIOURETHANE - BASED OPTICAL MATERIAL KOC SOLUTION CO., LTD. (KR) 2015-08-13 US claimed
EP-2891672-A1 METHOD FOR MANUFACTURING THIOURETHANE-BASED OPTICAL MATERIAL KOC Solution Co. Ltd. (KR) 2015-07-08 EP claimed
US-20140039145-A1 METHOD OF PRODUCING RESIN FOR THIOURETHANE-BASED OPTICAL MATERIAL USING GENERAL-PURPOSE POLYISOCYANATE COMPOUND, RESIN COMPOSITION FOR THIOURETHANE-BASED OPTICAL MATERIAL AND THIOURETHANE-BASED OPTICAL MATERIAL INCLUDING RESIN PRODUCED BY THE METHOD KOC SOLUTION CO LTD (KR) 2014-02-06 US claimed
EP-2682430-A2 METHOD FOR MANUFACTURING RESIN FOR THIOURETHANE-BASED OPTICAL MATERIAL USING UNIVERSAL POLYISOCYANATE COMPOUND, RESIN COMPOSITION, AND OPTICAL MATERIAL MANUFACTURED THEREBY Koc Solution Co.,LTD. (KR) 2014-01-08 EP claimed
US-20130303721-A1 METHOD FOR MANUFACTURING RESIN FOR URETHANE-BASED OPTICAL MATERIAL, RESIN COMPOSITION FOR SAME, AND OPTICAL MATERIAL MANUFACTURED THEREBY MITSUI CHEMICALS, INC. (JP) 2013-11-14 US claimed
EP-2660262-A2 METHOD FOR MANUFACTURING RESIN FOR URETHANE-BASED OPTICAL MATERIAL, RESIN COMPOSITION FOR SAME, AND OPTICAL MATERIAL MANUFACTURED THEREBY Koc Solution Co.,LTD. (KR) 2013-11-06 EP claimed
US-6384174-B1 None US disclosed
US-11987552-B2 Polymeric phenolic antioxidants MILLIKEN & COMPANY (US) 2024-05-21 US disclosed
US-11958937-B2 Polymerizable composition and optical material produced therefrom SK PUCORE CO., LTD. (KR) 2024-04-16 US disclosed
WO-2024053774-A1 PHOTOCURABLE RESIN COMPOSITION FOR ELECTRODE PROTECTION, AND PREPARATION METHOD THEREFOR 주식회사 한솔케미칼 2024-03-14 WO disclosed
EP-3539998-B1 METHOD FOR MANUFACTURING RESIN FOR URETHANE-BASED OPTICAL MATERIAL, RESIN COMPOSITION FOR SAME, AND OPTICAL MATERIAL MANUFACTURED THEREBY MITSUI CHEMICALS INC (JP) 2023-10-18 EP disclosed
EP-0328342-A2 Process for producing aromatic polyamides MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-08-16 EP disclosed
US-4837198-A HEAT RESISTANT LAYER OF RESIN AND MODIFIER WHICH IS REACTION PRODUCT OF FLUORINE COMPOUND AND ORGANIC POLYISOCYANATE DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 1989-06-06 US disclosed
EP-0303729-A1 Heat-sensitive recording medium DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) 1989-02-22 EP disclosed
EP-0280763-A2 Heat-sensitive recording medium DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) 1988-09-07 EP disclosed
US-4590255-A Preparation of ionomers and polyurethane elastomers from carboxylic acid-containing monoether and polyether polyol addition products OLIN CORPORATION (US) 1986-05-20 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 (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-11987552-B2 Polymeric phenolic antioxidants COMT, GPX4, PAH HIF1A 1397/4885KDM4E 307/4885MAPT 798/4885

“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.