SCHEMBL4779758

SCHEMBL4779758

COCCOc1cc2c(-n3ncc4c(Br)cccc43)cnnc2cc1OC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.44
FLT1 P17948 3/20 0.44
FGFR1 P11362 2/20 0.44
FBP1 P09467 1/20 0.41
PDE10A Q9Y233 4/20 0.38
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
PDPK1 O15530 3/20 0.35
KDM1A O60341 2/20 0.35
TYK2 P29597 1/20 0.35
ATM Q13315 1/20 0.35
NEK9 Q8TD19 1/20 0.35
NEK6 Q9HC98 1/20 0.35
CSF1R P07333 2/20 0.35
PDGFRB P09619 2/20 0.35
FLT3 P36888 2/20 0.35
FLT4 P35916 1/20 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
SCHEMBL5479282 0.91 FLT1 (0.46) KDRFLT1FGFR1FBP1PDE10A
SCHEMBL4778828 0.91 PDE10A (0.43) PDE10AEGFRPDGFRB
SCHEMBL4975789 0.90 FLT1 (0.44) KDRFLT1FGFR1FBP1PDE10A
SCHEMBL4776351 0.85 EHMT2 (0.47) KDRFLT1FGFR1PDE10APDPK1
SCHEMBL4793421 0.84 NCF1 (0.49) KDRFLT1FGFR1PDE10APDPK1
SCHEMBL4791838 0.83 KDR (0.44) KDRFLT1FGFR1FBP1PDE10A
SCHEMBL4792601 0.80 HTR1A (0.43) KDRFLT1FGFR1PDE10AKDM1A
SCHEMBL5653771 0.77 KDR (0.41) KDRFLT1FGFR1PDE10APDPK1
SCHEMBL5651040 0.77 FLT1 (0.41) KDRFLT1FGFR1PDE10APDPK1
SCHEMBL4793196 0.77 KDR (0.42) KDRFLT1FGFR1PDE10APDPK1

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-1991531-A1 CINNOLINE AND QUINOXALINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
US-20070287707-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-12-13 US disclosed
WO-2007100880-A1 CINNOLINE AND QUINAZOLINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-07 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 (1 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-20070287707-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A KDR 4714/4885FLT1 4564/4885FGFR1 2917/4885

“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.