SCHEMBL8233451

SCHEMBL8233451

CC(C)n1cc(C(=O)C=CN(C)C)c(I)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
RECQL P46063 2/20 0.37
LMNA P02545 3/20 0.36
RAB9A P51151 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
HPGD P15428 2/20 0.36
ALOX12 P18054 1/20 0.36
GAA P10253 2/20 0.35
ALDH1A1 P00352 6/20 0.35
POLB P06746 3/20 0.35
KMT2A Q03164 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.35
NPC1 O15118 1/20 0.35
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL8233450 1.00 MAPT (0.39) MAPTHTTTDP1RECQLLMNA
SCHEMBL8231746 0.81 HTT (0.41) MAPTHTTTDP1RECQLLMNA
SCHEMBL8231748 0.81 HTT (0.41) MAPTHTTTDP1RECQLLMNA
SCHEMBL3756939 0.77 HTT (0.39) MAPTHTTTDP1RECQLLMNA
SCHEMBL3756943 0.77 HTT (0.39) MAPTHTTTDP1RECQLLMNA
SCHEMBL8230261 0.75 ADORA2A (0.36) HTTCYP2C19ALDH1A1POLBSMN1; SMN2
SCHEMBL28694360 0.73 ADORA2A (0.44) TDP1POLB
SCHEMBL27890560 0.71 ADORA2A (0.35) KMT2A
SCHEMBL3757896 0.70 MAPT (0.33) MAPTHTTTDP1RECQLLMNA
SCHEMBL3757901 0.70 MAPT (0.33) MAPTHTTTDP1RECQLLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49556-E1 Compounds and compositions as protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-06-20 US claimed
US-8501758-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2013-08-06 US claimed
EP-2470526-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2012-07-04 EP claimed
US-20110306625-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-12-15 US claimed
WO-2011025927-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2011-03-03 WO claimed
US-RE49556-E1 Compounds and compositions as protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-06-20 US disclosed
US-20230116233-A1 Compounds And Compositions As Protein Kinase Inhibitors ARRAY BIOPHARMA INC (US) 2023-04-13 US disclosed
US-20200323852-A1 Compounds And Compositions As Protein Kinase Inhibitors IRM LLC (BM) 2020-10-15 US disclosed
US-10576080-B2 Compounds and compositions as protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2020-03-03 US disclosed
US-10568884-B2 Compounds and compositions as protein kinase inhibitors ARRAY BIOPHARMA INC. (US) 2020-02-25 US disclosed
US-20180297985-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2018-10-18 US disclosed
US-20180297986-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2018-10-18 US disclosed
US-9314464-B2 Compounds and compositions as protein kinase inhibitors NOVARTIS AG (CH) 2016-04-19 US disclosed
EP-2470526-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2014-05-28 EP disclosed
EP-2727918-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2014-05-07 EP disclosed
US-20130296318-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2013-11-07 US disclosed
US-8501758-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2013-08-06 US disclosed
EP-2470526-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2012-07-04 EP disclosed
US-20110306625-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-12-15 US disclosed
WO-2011025927-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2011-03-03 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-20200323852-A1 Compounds And Compositions As Protein Kinase Inhibitors BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-20110306625-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-20130296318-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-10568884-B2 Compounds and compositions as protein kinase inhibitors BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-20180297985-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-20230116233-A1 Compounds And Compositions As Protein Kinase Inhibitors BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-20180297986-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885
US-10576080-B2 Compounds and compositions as protein kinase inhibitors BRAF, RAF1, ARAF MAPT 1828/4885HTT 2739/4885TDP1 1617/4885

“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.