SCHEMBL6808845

SCHEMBL6808845

CC(C)c1cccc(C(C)C)c1NC(=O)N(CC(C)(C)c1cn(C)c2ccccc12)C(c1ccccn1)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NMBR P28336 5/20 0.36
GRPR P30550 1/20 0.36
TP53 P04637 4/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.34
ACKR3 P25106 1/20 0.33

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
SCHEMBL6183997 0.78 NMBR (0.41) NMBRGRPRLMNAMEN1KMT2A
SCHEMBL6808838 0.77 NMBR (0.46) NMBRGRPR
SCHEMBL6808987 0.76 NMBR (0.38) NMBRGRPRMAPTMEN1KMT2A
SCHEMBL6186318 0.76 SOAT1 (0.40) NMBRGRPR
SCHEMBL6803558 0.75 UBE2M (0.39) NMBRGRPR
SCHEMBL6805345 0.75 UBE2M (0.43) NMBRGRPRLMNAMEN1KMT2A
SCHEMBL6183039 0.74 UBE2M (0.37) NMBRGRPRLMNAMEN1KMT2A
SCHEMBL6801844 0.73 UBE2M (0.41) NMBRGRPRLMNAMEN1KMT2A
SCHEMBL6808030 0.71 UBE2M (0.39) NMBRGRPRLMNAMEN1KMT2A
SCHEMBL6185668 0.71 MEN1 (0.37) NMBRGRPRMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063643-A1 Bombesin antagonists PFIZER INC. 2004-04-01 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-20040063643-A1 Bombesin antagonists BRS3, NPSR1, GNRHR NMBR 211/4885GRPR 12/4885TP53 4818/4885

“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.