SCHEMBL502216

SCHEMBL502216

Cc1cc2c(cn1)cc(-c1cc(C(=O)Nc3ccc(F)cn3)ccc1C)c(=O)n2C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.51
MAPK14 Q16539 12/20 0.49
ABL1 P00519 4/20 0.46
RXFP1 Q9HBX9 1/20 0.45
MAPKAPK2 P49137 2/20 0.44
LCK P06239 1/20 0.44
KIT P10721 1/20 0.44
KDR P35968 1/20 0.44
MAPK13 O15264 1/20 0.44
RAF1 P04049 1/20 0.44
PDGFRA P16234 1/20 0.44
MAPK12 P53778 1/20 0.44
KCNH2 Q12809 1/20 0.44
MAPK11 Q15759 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GRM5 P41594 1/20 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
SCHEMBL502061 0.91 CNR1 (0.48) MAPK14RXFP1KDM4E
SCHEMBL10043907 0.89 RAB9A (0.51) MAPK14RXFP1KDM4E
SCHEMBL10043922 0.89 MAPK14 (0.48) AHRMAPK14ABL1MAPKAPK2LCK
SCHEMBL10043926 0.87 MAPK14 (0.45) MAPK14ABL1RXFP1MAPKAPK2LCK
SCHEMBL10043898 0.87 MAPK14 (0.47) MAPK14ABL1MAPKAPK2LCKKIT
SCHEMBL10043913 0.86 RXFP1 (0.43) MAPK14ABL1RXFP1MAPKAPK2MAPK13
SCHEMBL10043920 0.86 MAPK14 (0.48) MAPK14MAPKAPK2LCKKITKDR
SCHEMBL10043921 0.86 MAPK14 (0.52) MAPK14MAPKAPK2LCKKITKDR
SCHEMBL10043912 0.86 NPC1 (0.51) MAPK14RXFP1MAPKAPK2LCKKIT
SCHEMBL10043911 0.85 MAPK14 (0.62) MAPK14LCKKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106068-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2012-01-31 US disclosed
US-8106068-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2012-01-31 US disclosed
US-8106068-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2012-01-31 US disclosed
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2010-04-01 US disclosed
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2010-04-01 US disclosed
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2010-04-01 US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 US disclosed
EP-2076513-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2009-07-08 EP disclosed
US-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2008-07-24 US disclosed
US-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2008-07-24 US disclosed
US-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2008-07-24 US disclosed
WO-2008051757-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2008-05-02 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-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC AHR 2257/4885MAPK14 117/4885ABL1 59/4885
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC AHR 2257/4885MAPK14 117/4885ABL1 59/4885

“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.