SCHEMBL5599082

SCHEMBL5599082

CC1=CC(C)(C)NC(C)(C)C1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ GLA P06280 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL4253446 0.73 SMN1; SMN2 (0.53) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL5489748 0.73 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL19102433 0.73 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL20936054 0.73 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL15329364 0.69 SMN1; SMN2 (0.41) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL11134639 0.69 SMN1; SMN2 (0.41) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL12499138 0.69 SMN1; SMN2 (0.44) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL20170088 0.68 SMN1; SMN2 (0.40) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1
SCHEMBL14564596 0.67 SMN1; SMN2 (0.40) SMN1; SMN2GLAKMT2AL3MBTL1
SCHEMBL20170045 0.67 SMN1; SMN2 (0.43) SMN1; SMN2GLAKMT2AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235885-A1 COMPOSITION AND METHOD FOR INHIBITING POLYMERIZATION AND POLYMER GROWTH Uniroyal Chemical Company, Inc. (US) 2002-09-04 — — EP claimed
WO-2001040404-A1 COMPOSITION AND METHOD FOR INHIBITING POLYMERIZATION AND POLYMER GROWTH UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-06-07 — — WO claimed
US-20230218597-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-07-13 — — US disclosed
US-20230218597-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-07-13 — — US disclosed
US-11590116-B2 Substituted pyridines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-02-28 — — US disclosed
US-11123348-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2021-09-21 — — US disclosed
WO-2021102468-A1 SUBSTITUTED 1,5-NAPHTHYRIDINES OR QUINOLINES AS ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-05-27 — — WO disclosed
US-20210154179-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-05-27 — — US disclosed
US-20200179391-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS INSTITUTE FOR FUNCTIONAL GENOMICS, INC. DBA THE GENOMICS INSTITUTE OF THE NOVARTIS RESEARCH FOUNDATION 2020-06-11 — — US disclosed
US-10596175-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2020-03-24 — — US disclosed
US-9700559-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2017-07-11 — — US disclosed
US-9303034-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2016-04-05 — — US disclosed
US-20150175613-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES IRM LLC (BM) 2015-06-25 — — US disclosed
US-20150175613-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES IRM LLC (BM) 2015-06-25 — — US disclosed
EP-1794106-A1 SULFONATED PHENOLS WITH NITROPHENOLS AS POLYMERIZATION INHIBITORS Chemtura Corporation (US) 2007-06-13 — — EP disclosed
US-20070072912-A1 Alicyclic-amine-substituted 4-carboxamido-benzimidazoles as parp-inhibitors and antioxidants CEDARS-SINAI MEDICAL CENTER (US) 2007-03-29 — — US disclosed
US-20070072912-A1 Alicyclic-amine-substituted 4-carboxamido-benzimidazoles as parp-inhibitors and antioxidants CEDARS-SINAI MEDICAL CENTER (US) 2007-03-29 — — US disclosed
WO-2006036274-A1 SULFONATED PHENOLS WITH NITROPHENOLS AS POLYMERIZATION INHIBITORS CHEMTURA CORPORATION (US) 2006-04-06 — — WO disclosed
EP-1248757-A1 INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS Uniroyal Chemical Company, Inc. (US) 2002-10-16 — — EP disclosed
WO-2001053235-A1 INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-07-26 — — 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 (8 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-20150175613-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-11123348-B2 Compounds and compositions for the treatment of parasitic diseases TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-20210154179-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE ALK, ACVR1, ACVR2A SMN1; SMN2 2449/4885GLA 1811/4885KMT2A 3260/4885
US-10596175-B2 Compounds and compositions for the treatment of parasitic diseases TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-20070072912-A1 Alicyclic-amine-substituted 4-carboxamido-benzimidazoles as parp-inhibitors and antioxidants PARP1, PARP2, PARP11 SMN1; SMN2 1471/4885GLA 2323/4885KMT2A 735/4885
US-20230218597-A1 SUBSTITUTED PYRIDINES AND METHODS OF USE ALK, ACVR1, ACVR2A SMN1; SMN2 2449/4885GLA 1811/4885KMT2A 3260/4885
US-20200179391-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES TYR, TBCA, MAPT SMN1; SMN2 705/4885GLA 1449/4885KMT2A 2041/4885
US-11590116-B2 Substituted pyridines and methods of use ALK, ACVR1, ACVR2A SMN1; SMN2 2449/4885GLA 1811/4885KMT2A 3260/4885

“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.

Send feedback