SCHEMBL4426075

SCHEMBL4426075

Nc1cc(-c2cc3cnc(Cl)cc3n(-c3ccccc3)c2=O)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 6/20 0.46
BRD4 O60885 1/20 0.41
LYN P07948 4/20 0.40
SRC P12931 3/20 0.40
USP2 O75604 6/20 0.38
CYP1A2 P05177 6/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
MAT2A P31153 1/20 0.37
TDP2 O95551 2/20 0.36
HSD17B10 Q99714 4/20 0.35
HIF1A Q16665 3/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP2D6 P10635 3/20 0.35
CASP1 P29466 3/20 0.35
CASP7 P55210 3/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL4431201 0.85 BTK (0.53) BTKBRD4LYNSRCFGFR1
SCHEMBL17119663 0.84 BTK (0.48) BTKLYNSRCUSP2CYP1A2
SCHEMBL5061438 0.82 FGFR1 (0.49) BRD4LYNSRCFGFR1
SCHEMBL4420935 0.82 SRC (0.47) BTKLYNSRC
SCHEMBL17119638 0.81 BTK (0.67) BTKLYNSRCFGFR1
SCHEMBL4566546 0.80 BTK (0.44) BTKBRD4LYNSRCHSD17B10
SCHEMBL17119643 0.78 BTK (0.52) BTKLYNSRCMEN1KMT2A
SCHEMBL17119649 0.76 BTK (0.53) BTKLYNSRCMAT2A
SCHEMBL5065372 0.75 BTK (0.42) BTKLYNSRCUSP2CYP1A2
SCHEMBL501865 0.75 PLA2G7 (0.41) BTKBRD4LYNSRCMAT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2012-11-15 US disclosed
US-8188113-B2 For example, 1-(5-(2-amino-8-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-6-yl)-2-fluorophenyl)-3-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)urea; for treatment of mammalian cancers and inflammatory diseases including rheumatoid arthritis, retinopathies DECIPHERA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
EP-2063897-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2009-06-03 EP disclosed
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PARMACEUTICALS, LLC (US) 2008-05-15 US disclosed
WO-2008034008-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC. (US) 2008-03-20 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 (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-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES BRAF, PRKDC, RAF1 BTK 492/4885BRD4 1320/4885LYN 428/4885
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 BTK 492/4885BRD4 1320/4885LYN 428/4885

“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.