SCHEMBL5873426

SCHEMBL5873426

CC(C)(C)OC(=O)N1CCCC1CCOc1cc(NC(=O)c2cccnc2Nc2ccc3cn[nH]c3c2)ccc1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.51
MET P08581 1/20 0.39
TRPV1 Q8NER1 5/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 1/20 0.37
CHEK2 O96017 1/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SYK P43405 1/20 0.37
BTK Q06187 1/20 0.37
USP2 O75604 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PTGES O14684 2/20 0.36
EP300 Q09472 1/20 0.36
FLT1 P17948 1/20 0.35
GRK2 P25098 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
SCHEMBL13867926 0.94 KDR (0.51) KDRMETTRPV1NPC1RAB9A
SCHEMBL3901456 0.94 KDR (0.51) KDRMETTRPV1NPC1RAB9A
SCHEMBL5873423 0.87 KDR (0.51) KDRMETTRPV1NPC1RAB9A
SCHEMBL4554949 0.84 KDR (0.52) KDRMETTRPV1NPC1RAB9A
SCHEMBL4554734 0.82 KDR (0.52) KDRMETTRPV1NPC1RAB9A
SCHEMBL13867895 0.81 KDR (0.51) KDRTRPV1NPC1RAB9ASMN1; SMN2
SCHEMBL4553873 0.80 KDR (0.54) KDRMETTRPV1NPC1RAB9A
SCHEMBL13867931 0.80 KDR (0.54) KDRMETTRPV1NPC1RAB9A
SCHEMBL3892509 0.80 KDR (0.54) KDRMETTRPV1NPC1RAB9A
SCHEMBL631358 0.80 KDR (0.55) KDRTRPV1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105682-B2 Substituted amine derivatives and methods of use AMGEN INC. (US) 2006-09-12 US disclosed
US-20030195230-A1 Substituted amine derivatives and methods of use AMGEN INC. 2003-10-16 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 (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-20030195230-A1 Substituted amine derivatives and methods of use MAOB, HNMT, FLT4 KDR 13/4885MET 287/4885TRPV1 3811/4885

“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.