SCHEMBL1856476

SCHEMBL1856476

CCOC(=O)c1cccc(-c2cccc3cc(Cc4ccc(F)c(F)c4)oc23)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 2/20 0.51
PRKDC P78527 1/20 0.44
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38

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
SCHEMBL1849788 0.92 GPR52 (0.48) GPR52PRKDCTP53POLBHPGD
SCHEMBL3208407 0.92 GPR52 (0.49) GPR52PRKDCTP53POLBHPGD
SCHEMBL1854648 0.88 GPR52 (0.47) GPR52PRKDCTP53POLBHPGD
SCHEMBL1854762 0.88 GPR52 (0.46) GPR52PRKDCTP53POLBHPGD
SCHEMBL1862634 0.87 GPR52 (0.44) GPR52PRKDCTP53POLBHPGD
SCHEMBL1849559 0.87 GPR52 (0.52) GPR52PRKDCTP53POLBHPGD
SCHEMBL1855057 0.86 GPR52 (0.54) GPR52MAOA
SCHEMBL1852323 0.84 GPR52 (0.49) GPR52PRKDCTP53POLBHPGD
SCHEMBL1850789 0.82 GPR52 (0.53) GPR52PRKDCTP53POLBHPGD
SCHEMBL1849493 0.80 GPR52 (0.75) GPR52TP53

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 1/4885PRKDC 4721/4885TP53 3403/4885

“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.