SCHEMBL15445610

SCHEMBL15445610

Cc1ccc(-c2nc3cc(CN4CCN(C)CC4)ccc3[nH]2)cc1I

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
KIT P10721 7/20 0.49
GSK3B P49841 1/20 0.47
FGFR1 P11362 3/20 0.47
FLT1 P17948 1/20 0.47
PARP1 P09874 3/20 0.45
KDR P35968 2/20 0.43
PDGFRB P09619 1/20 0.43
HRH4 Q9H3N8 1/20 0.42
FGFR2 P21802 1/20 0.42
FGFR3 P22607 1/20 0.42
TNKS O95271 1/20 0.42
DRD3 P35462 1/20 0.42
MAP3K11 Q16584 2/20 0.42

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
SCHEMBL15442512 0.92 FGFR1 (0.57) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL20144354 0.90 HDAC3 (0.52) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL21017831 0.82 HDAC6 (0.62) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL15442516 0.80 HDAC6 (0.58) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL8262968 0.78 FGFR1 (0.49) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL2934367 0.77 LMNA (0.53) HDAC6KITPARP1TNKS
SCHEMBL21087550 0.76 HDAC6 (0.58) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL15451449 0.75 FGFR1 (0.60) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL28498762 0.72 FGFR1 (0.54) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL30060858 0.72 FGFR1 (0.54) HDAC3HDAC1HDAC2HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3186247-B1 PROTEIN KINASE INHIBITORS ASTAR BIOTECH LLC (US) 2021-03-03 EP disclosed
EP-2880038-B1 PROTEIN KINASE INHIBITORS ASTAR BIOTECH LLC (US) 2018-05-16 EP disclosed
WO-2016029776-A1 PROTEIN KINASE INHIBITORS ASTAR BIOTECH LLC (US) 2016-03-03 WO disclosed
US-9174996-B2 Protein kinase inhibitors ASTAR BIOTECH LLC (US) 2015-11-03 US disclosed
US-9174996-B2 Protein kinase inhibitors ASTAR BIOTECH LLC (US) 2015-11-03 US disclosed
US-20140364436-A1 Protein Kinase Inhibitors ASTAR BIOTECH LLC (US) 2014-12-11 US disclosed
US-20140364436-A1 Protein Kinase Inhibitors ASTAR BIOTECH LLC (US) 2014-12-11 US disclosed
US-8859553-B2 Protein kinase inhibitors ASTAR BIOTECH LLC (US) 2014-10-14 US disclosed
US-8859553-B2 Protein kinase inhibitors ASTAR BIOTECH LLC (US) 2014-10-14 US disclosed
WO-2014019338-A1 PROTEIN KINASE INHIBITORS ASTAR BIOTECH LLC (US) 2014-02-06 WO disclosed
US-20140031354-A1 Protein Kinase Inhibitors ASTAR BIOTECH LLC (US) 2014-01-30 US disclosed
US-20140031354-A1 Protein Kinase Inhibitors ASTAR BIOTECH LLC (US) 2014-01-30 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 (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-20140364436-A1 Protein Kinase Inhibitors MAP3K9, MAP3K6, MAP3K8 HDAC3 1009/4885HDAC1 988/4885HDAC2 1044/4885
US-20140031354-A1 Protein Kinase Inhibitors MAP3K1, MAP3K5, MAP3K7 HDAC3 725/4885HDAC1 605/4885HDAC2 760/4885

“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.