SCHEMBL2202129

SCHEMBL2202129

O=C1Nc2ccc(F)cc2/C1=C1\OCc2c1cnc(N1CCOCC1)c2Cl

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.44
KDR P35968 6/20 0.41
PDGFRB P09619 5/20 0.41
KIT P10721 5/20 0.41
GRIA1 P42261 4/20 0.40
TOP1 P11387 2/20 0.37
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
FLT1 P17948 1/20 0.36
FLT3 P36888 2/20 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
SCHEMBL2202131 1.00 LRRK2 (0.44) LRRK2KDRPDGFRBKITGRIA1
SCHEMBL2199139 0.90 CHRM1 (0.40) LRRK2KDRPDGFRBKITTOP1
SCHEMBL2199144 0.90 CHRM1 (0.40) LRRK2KDRPDGFRBKITTOP1
SCHEMBL2201662 0.83 TOP1 (0.40) LRRK2KDRPDGFRBKITTOP1
SCHEMBL2201665 0.83 TOP1 (0.40) LRRK2KDRPDGFRBKITTOP1
SCHEMBL2201910 0.83 NR1H2 (0.39) KDRPDGFRBKITGRIA1TOP1
SCHEMBL2201914 0.83 NR1H2 (0.39) KDRPDGFRBKITGRIA1TOP1
SCHEMBL2203113 0.76 PDGFRB (0.45) LRRK2KDRPDGFRBKITTOP1
SCHEMBL2203116 0.76 PDGFRB (0.45) LRRK2KDRPDGFRBKITTOP1
SCHEMBL2200940 0.74 TOP1 (0.39) LRRK2KDRPDGFRBKITTOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455535-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2013-06-04 US disclosed
US-8455535-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2013-06-04 US disclosed
US-8455535-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2013-06-04 US disclosed
US-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors ALLERGAN, INC. (US) 2011-10-20 US disclosed
US-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors ALLERGAN, INC. (US) 2011-10-20 US disclosed
US-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors ALLERGAN, INC. (US) 2011-10-20 US disclosed
US-7977351-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2011-07-12 US disclosed
US-7977351-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2011-07-12 US disclosed
US-7977351-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2011-07-12 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 US disclosed
WO-2007109596-A2 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. (US) 2007-09-27 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-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors REN, JAK2, ABL1 LRRK2 339/4885KDR 25/4885PDGFRB 11/4885
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS REN, JAK2, ABL1 LRRK2 339/4885KDR 25/4885PDGFRB 11/4885

“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.