SCHEMBL3209948

SCHEMBL3209948

CCOC(=O)c1cccc(-c2ncnc3cc(Cc4cccc(C(F)(F)F)c4)sc23)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 8/20 0.48
BRAF P15056 1/20 0.48
MAPT P10636 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SCD O00767 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
SYK P43405 1/20 0.41

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
SCHEMBL1850139 0.88 BRAF (0.51) GPR52BRAFMEN1KMT2ASCD
SCHEMBL1853988 0.87 GPR52 (0.53) GPR52MAPTMEN1KMT2ASCD
SCHEMBL1850856 0.84 GPR52 (0.51) GPR52MAPTMEN1KMT2ASCD
SCHEMBL1850936 0.84 STK17B (0.46) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL1850901 0.83 STK17B (0.46) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL3219231 0.82 GPR52 (0.69) GPR52BRAFSCD
SCHEMBL1848119 0.81 GPR52 (0.71) GPR52MAPTMEN1KMT2AALDH1A1
SCHEMBL1848379 0.79 GPR52 (0.69) GPR52MAPTMEN1KMT2ASCD
SCHEMBL1848416 0.79 GPR52 (0.59) GPR52MAPTMEN1KMT2AALDH1A1
SCHEMBL3211107 0.79 GPR52 (0.54) GPR52MAPTMEN1KMT2AALDH1A1

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-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 GPR52 1/4885BRAF 4083/4885MAPT 4174/4885

“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.