SCHEMBL4352175

SCHEMBL4352175

Cc1[nH]c(C=C2C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCCC(O)CC(O)CC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAA1 Q13131 8/20 0.71
PRKAA2 P54646 7/20 0.71
PDGFRB P09619 12/20 0.70
KDR P35968 11/20 0.70
CSF1R P07333 4/20 0.70
ABCB11 O95342 2/20 0.70
TLK2 Q86UE8 4/20 0.70
FGFR1 P11362 7/20 0.69
HDAC3 O15379 3/20 0.68
HDAC4 P56524 3/20 0.68
HDAC1 Q13547 3/20 0.68
HDAC7 Q8WUI4 3/20 0.68
HDAC2 Q92769 3/20 0.68
HDAC10 Q969S8 3/20 0.68
HDAC11 Q96DB2 3/20 0.68
HDAC8 Q9BY41 3/20 0.68
HDAC6 Q9UBN7 3/20 0.68
HDAC9 Q9UKV0 3/20 0.68
HDAC5 Q9UQL6 3/20 0.68
PLK4 O00444 3/20 0.67

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
SCHEMBL4200608 1.00 PRKAA1 (0.71) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL4200611 1.00 PRKAA1 (0.71) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276316 0.94 PRKAA1 (0.71) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276313 0.94 PRKAA1 (0.71) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276359 0.93 PRKAA1 (0.72) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276342 0.92 PRKAA1 (0.69) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276323 0.92 PRKAA1 (0.69) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL4200636 0.92 PDGFRB (0.69) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276321 0.92 KDR (0.70) PRKAA1PRKAA2PDGFRBKDRCSF1R
SCHEMBL14276334 0.92 KDR (0.70) PRKAA1PRKAA2PDGFRBKDRCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1686987-A4 ADVANCED INDOLINONE BASED PROTEIN KINASE INHIBITORS SCRIPPS RESEARCH INST (US) 2009-02-25 EP disclosed
EP-1686987-A2 ADVANCED INDOLINONE BASED PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2006-08-09 EP disclosed
WO-2005053614-A2 ADVANCED INDOLINONE BASED PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2005-06-16 WO disclosed