SCHEMBL989636

SCHEMBL989636

CN(C)Cc1cccc(CN(C)C)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.67
TSHR P16473 2/20 0.67
NOS1 P29475 1/20 0.57
HRH3 Q9Y5N1 1/20 0.52
CHRNB2 P17787 1/20 0.52
CHRNA4 P43681 1/20 0.52
HTR7 P34969 2/20 0.52
TAAR1 Q96RJ0 5/20 0.50
HPGD P15428 1/20 0.49
ACHE P22303 1/20 0.48
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL13462516 0.91 ALDH1A1 (0.56) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL2646040 0.89 ALDH1A1 (0.54) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL10850985 0.89 ALDH1A1 (0.54) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL10292257 0.89 ALDH1A1 (0.54) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL2464280 0.89 ALDH1A1 (0.54) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL10850997 0.89 ALDH1A1 (0.54) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL15304957 0.89 ALDH1A1 (0.54) ALDH1A1TSHRNOS1HRH3CHRNB2
Hydrochloric Acid SCHEMBL9023424 0.87 TSHR (0.52) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL8494349 0.87 ALDH1A1 (0.52) ALDH1A1TSHRNOS1HRH3CHRNB2
SCHEMBL26686942 0.87 TSHR (0.52) ALDH1A1TSHRNOS1HRH3CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115925581-A Method for preparing isocyanate 万华化学集团股份有限公司 2023-04-07 CN claimed
US-9309381-B2 Epoxy resin compositions using solvated solids AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-04-12 US claimed
EP-2486975-B1 FAST MIXING REACTOR AND USE THEREOF WANHUA CHEMICAL GROUP CO LTD (CN) 2015-09-23 EP claimed
EP-2746328-A1 Epoxy resin compositions using solvated solids AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-06-25 EP claimed
US-20140171551-A1 Epoxy Resin Compositions Using Solvated Solids AIR PRODUCTS AND CHEMICALS INC. (US) 2014-06-19 US claimed
EP-2723793-A1 EPOXY RESIN COMPOSITIONS Air Products and Chemicals, Inc. (US) 2014-04-30 EP claimed
US-20120328811-A1 Epoxy Resin Compositions AIR PRODUCTS AND CHEMICALS, INC. (US) 2012-12-27 US claimed
WO-2012174989-A1 EPOXY RESIN COMPOSITIONS AIR PRODUCTS AND CHEMICALS, INC. (US) 2012-12-27 WO claimed
US-7001973-B2 Catalyst and process for preparing low-viscosity and color-reduced polyisocyanates containing isocyanurate groups DEGUSSA AG (DE) 2006-02-21 US claimed
US-20030187178-A1 Catalyst and process for preparing low-viscosity and color-reduced polyisocyanates containing isocyanurate groups DEGUSSA AG (DE) 2003-10-02 US claimed
US-6613863-B2 Benzyltrialkylammonium carboxylate isocyanate trimerization catalysts DEGUSSA AG (DE) 2003-09-02 US claimed
US-20020120089-A1 Catalyst and process for preparing low-viscosity and color-reduced polyisocyanates containing isocyanurate groups DEGUSSA AG (DE) 2002-08-29 US claimed
US-12540261-B2 Anti-flutter adhesive composition HENKEL AG & CO. KGAA (DE) 2026-02-03 US disclosed
US-20260009122-A1 COMPOUNDS COMPRISING SULFUR AND (METH)ACRYLATE MOIETIES SUITABLE FOR BONDING ORGANIC POLYMERS TO METAL 3M INNOVATIVE PROPERTIES COMPANY (US) 2026-01-08 US disclosed
EP-4634274-A1 COMPOUNDS COMPRISING SULFUR AND (METH)ACRYLATE MOIETIES SUITABLE FOR BONDING ORGANIC POLYMERS TO METAL 3M Innovative Properties Company (US) 2025-10-22 EP disclosed
EP-3830169-B1 TWO-PART EPOXY BASED COMPOSITION HENKEL AG & CO KGAA (DE) 2025-04-16 EP disclosed
EP-0825175-A1 Quaternary ammonium disinfectant NICCA CHEMICAL CO., LTD. (JP) 1998-02-25 EP disclosed
EP-0542512-B1 Oxygen-scavenging composition MITSUBISHI GAS CHEMICAL CO (JP) 1995-07-26 EP disclosed
US-5387368-A A mixture of an aryl diamine, a transition metal compound and a phosphorus compound; prevents oxidation and decay of organic MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-02-07 US disclosed
EP-0542512-A1 Oxygen-scavenging composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-05-19 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 (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-12540261-B2 Anti-flutter adhesive composition ITGA1, ITGB1, ITGA2 ALDH1A1 1119/4885TSHR 1946/4885NOS1 2046/4885
US-20260009122-A1 COMPOUNDS COMPRISING SULFUR AND (METH)ACRYLATE MOIETIES SUITABLE FOR BONDING ORGANIC POLYMERS TO METAL MAT1A, MTR, MGMT ALDH1A1 85/4885TSHR 2186/4885NOS1 100/4885

“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.