SCHEMBL1847987

SCHEMBL1847987

CCOC(=O)c1cccc(-c2cccc3cc(C(C)(O)c4cccc(C(F)(F)F)c4)sc23)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 3/20 0.48
MAPT P10636 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
S1PR4 O95977 1/20 0.43
S1PR5 Q9H228 1/20 0.43
KDM4E B2RXH2 1/20 0.42
CNR2 P34972 1/20 0.42
SYK P43405 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GRM5 P41594 1/20 0.39

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
SCHEMBL3209033 0.87 GPR52 (0.47) GPR52MEN1KMT2AS1PR4S1PR5
SCHEMBL3215806 0.86 GPR52 (0.50) GPR52S1PR4S1PR5NPC1RAB9A
SCHEMBL1847676 0.84 GPR52 (0.44) GPR52MAPTS1PR4S1PR5ALDH1A1
SCHEMBL1847685 0.83 GPR52 (0.47) GPR52MEN1KMT2AS1PR4S1PR5
SCHEMBL3221889 0.83 GPR52 (0.71) GPR52S1PR4S1PR5ALDH1A1
SCHEMBL3206663 0.83 GPR52 (0.68) GPR52S1PR4S1PR5ALDH1A1
SCHEMBL1847683 0.82 MAPT (0.50) GPR52MAPTMEN1KMT2AALDH1A1
SCHEMBL3209846 0.82 GPR52 (0.69) GPR52S1PR4S1PR5ALDH1A1
SCHEMBL1848119 0.81 GPR52 (0.71) GPR52MAPTMEN1KMT2AS1PR4
SCHEMBL1851677 0.81 GPR52 (0.62) GPR52S1PR4S1PR5ALDH1A1

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
EP-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
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 1/4885MAPT 4174/4885MEN1 4760/4885

“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.