SCHEMBL4431201

SCHEMBL4431201

CNc1cc2c(cn1)cc(-c1ccc(F)c(N)c1)c(=O)n2-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 13/20 0.53
SRC P12931 10/20 0.48
LYN P07948 10/20 0.48
KRAS P01116 1/20 0.43
RAF1 P04049 1/20 0.43
BRAF P15056 1/20 0.43
KDR P35968 1/20 0.43
MAP2K2 P36507 1/20 0.43
MAP2K1 Q02750 1/20 0.43
FGFR1 P11362 1/20 0.42
BRD4 O60885 1/20 0.42
KIT P10721 1/20 0.41
PDGFRA P16234 1/20 0.41

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
SCHEMBL4426075 0.85 BTK (0.46) BTKSRCLYNFGFR1BRD4
SCHEMBL5066973 0.84 SRC (0.56) SRCLYNKRASRAF1BRAF
SCHEMBL4419856 0.84 KRAS (0.57) BTKSRCLYNKRASRAF1
SCHEMBL5057704 0.82 BTK (0.52) BTKSRCLYNKRASRAF1
SCHEMBL5061797 0.76 KDR (0.54) BTKSRCLYNKRASRAF1
SCHEMBL4427055 0.76 BRAF (0.63) BTKSRCLYNKRASRAF1
SCHEMBL5062674 0.75 BRAF (0.79) BTKSRCLYNKRASRAF1
SCHEMBL5065372 0.75 BTK (0.42) BTKSRCLYN
SCHEMBL22538190 0.72 SRC (0.41) BTKSRCLYNKRASRAF1
SCHEMBL4431906 0.71 SRC (0.57) SRCLYNBRAFKDRFGFR1

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 492/4885SRC 417/4885LYN 428/4885
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 BTK 492/4885SRC 417/4885LYN 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.