SCHEMBL20046484

SCHEMBL20046484

CC(C)c1ncc(-c2ccc(-c3ccc(C(C)S)cc3)cc2)n1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 4/20 0.41
TP53 P04637 2/20 0.41
GAA P10253 2/20 0.41
ATP1A1 P05023 10/20 0.38
ATP1B1 P05026 10/20 0.38
ATP1A3 P13637 10/20 0.38
ATP1B2 P14415 10/20 0.38
ATP1A2 P50993 10/20 0.38
ATP1B3 P54709 10/20 0.38
FXYD2 P54710 10/20 0.38
ATP1A4 Q13733 10/20 0.38
USP2 O75604 2/20 0.37
MAPK1 P28482 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP3A4 P08684 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 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
SCHEMBL20046490 0.89 LMNA (0.55) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL22692182 0.88 LMNA (0.45) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL23483078 0.82 MAPT (0.50) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL23483079 0.82 MAPT (0.42) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL20075874 0.81 MAPT (0.40) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL22692335 0.80 LMNA (0.37) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL24197722 0.79 GAA (0.50) LMNASMN1; SMN2TP53GAAATP1A1
SCHEMBL27217087 0.78 CYP1A2 (0.58) LMNASMN1; SMN2GAAATP1A1ATP1B1
SCHEMBL22964379 0.77 LMNA (0.38) LMNASMN1; SMN2MAPTTP53GAA
SCHEMBL20046815 0.77 MAPT (0.39) LMNASMN1; SMN2MAPTTP53GAA

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-20180099940-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2018-04-12 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-20180099940-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN LMNA 2932/4885SMN1; SMN2 3936/4885MAPT 2970/4885

“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.