SCHEMBL1855327

SCHEMBL1855327

COc1cccc(Cc2cc3cccc(-c4cccc(C(=O)NC5CCOCC5)c4)c3o2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 1/20 0.51
DRD4 P21917 2/20 0.47
MAPK14 Q16539 1/20 0.46
MCHR1 Q99705 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
HPGDS O60760 1/20 0.44
KMT2A Q03164 1/20 0.42
BRD4 O60885 1/20 0.42
CCR3 P51677 1/20 0.42
GRM5 P41594 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CCR2 P41597 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 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
SCHEMBL1849693 0.84 GPR52 (0.52) GPR52RAB9A
SCHEMBL3211200 0.80 SMYD2 (0.57) GPR52DRD4MAPT
SCHEMBL1850827 0.80 SMYD2 (0.54) GPR52DRD4MAPT
SCHEMBL7959088 0.78 TAS1R3 (0.53) GPR52
SCHEMBL1850921 0.76 GPR52 (0.49) GPR52NPC1RAB9AKMT2AALDH1A1
SCHEMBL30098987 0.76 ALDH1A1 (0.63) MCHR1NPC1RAB9AHPGDSKMT2A
SCHEMBL960682 0.74 GPR52 (0.51) GPR52DRD4MAPK14MCHR1NPC1
SCHEMBL20913786 0.72 BRD4 (0.77) DRD4NPC1RAB9AHPGDSBRD4
SCHEMBL3209922 0.72 GPR52 (0.49) GPR52NPC1RAB9AKMT2ATSHR
SCHEMBL3211510 0.72 GPR52 (0.72) GPR52DRD4KMT2ACCR2

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 5 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
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US 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 1/4885DRD4 784/4885MAPK14 2370/4885

“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.