SCHEMBL4556147

SCHEMBL4556147

CCC1CCc2nc(C(C)(C)C)ccc2C1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.38
DRD3 P35462 3/20 0.38
MAPT P10636 4/20 0.38
TP53 P04637 2/20 0.38
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
NPC1 O15118 1/20 0.32
SGPL1 O95470 1/20 0.31
S1PR1 P21453 1/20 0.31
LNPEP Q9UIQ6 1/20 0.31
CNR2 P34972 1/20 0.30

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
SCHEMBL4548608 0.78 MAPT (0.42) DRD2DRD3MAPTTP53NPC1
SCHEMBL8009305 0.70 DRD2 (0.58) DRD2DRD3NOS3NOS1NOS2
SCHEMBL18806199 0.70 ADRA2A (0.40) NPC1
SCHEMBL6857053 0.70 ADRA2A (0.43) NPC1
SCHEMBL25446903 0.69
SCHEMBL25031271 0.69
SCHEMBL24378402 0.68 ADRA2A (0.42)
SCHEMBL20877628 0.68 ADRA2A (0.42)
SCHEMBL21107629 0.68 ADRA2A (0.42)
SCHEMBL21107870 0.68 ADRA2A (0.42)

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
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 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-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET DRD2 4255/4885DRD3 4435/4885MAPT 2653/4885

“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.