SCHEMBL2199144

SCHEMBL2199144

CN1CCN(c2ncc3c(c2Cl)COC3=C2C(=O)Nc3ccc(F)cc32)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.40
HRH1 P35367 1/20 0.40
PAK1 Q13153 1/20 0.40
TOP1 P11387 2/20 0.39
TNK2 Q07912 3/20 0.36
WEE1 P30291 1/20 0.36
PDGFRB P09619 4/20 0.36
KIT P10721 4/20 0.36
KDR P35968 4/20 0.36
LRRK2 Q5S007 2/20 0.35
HRH4 Q9H3N8 1/20 0.34
FLT3 P36888 1/20 0.34
EGFR P00533 1/20 0.34
POLB P06746 1/20 0.34
TDO2 P48775 1/20 0.34

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
SCHEMBL2199139 1.00 CHRM1 (0.40) CHRM1HRH1PAK1TOP1TNK2
SCHEMBL2202129 0.90 LRRK2 (0.44) TOP1PDGFRBKITKDRLRRK2
SCHEMBL2202131 0.90 LRRK2 (0.44) TOP1PDGFRBKITKDRLRRK2
SCHEMBL2201914 0.85 NR1H2 (0.39) TOP1PDGFRBKITKDRTDO2
SCHEMBL2201910 0.85 NR1H2 (0.39) TOP1PDGFRBKITKDRTDO2
SCHEMBL2201665 0.83 TOP1 (0.40) TOP1PDGFRBKITKDRLRRK2
SCHEMBL2201662 0.83 TOP1 (0.40) TOP1PDGFRBKITKDRLRRK2
SCHEMBL2203113 0.77 PDGFRB (0.45) PAK1TOP1PDGFRBKITKDR
SCHEMBL2203116 0.77 PDGFRB (0.45) PAK1TOP1PDGFRBKITKDR
SCHEMBL2201016 0.75 PDGFRB (0.43) TOP1PDGFRBKITKDRFLT3

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 4 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-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-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 US 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 CHRM1 3646/4885HRH1 1464/4885PAK1 293/4885
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS REN, JAK2, ABL1 CHRM1 3646/4885HRH1 1464/4885PAK1 293/4885

“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.