SCHEMBL3216142

SCHEMBL3216142

COCCNC(=O)c1ccc(-c2cccc3cc(COc4cccc(C(F)(F)F)c4)sc23)cc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 10/20 0.65
S1PR4 O95977 3/20 0.48
S1PR5 Q9H228 3/20 0.48
MRGPRX4 Q96LA9 1/20 0.45
HDAC4 P56524 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
IGF1R P08069 1/20 0.44
MET P08581 1/20 0.44
SRC P12931 1/20 0.44
SPHK2 Q9NRA0 1/20 0.42
MAPT P10636 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
SCHEMBL1852296 0.94 GPR52 (0.59) GPR52S1PR4S1PR5MRGPRX4HDAC4
SCHEMBL3222989 0.92 GPR52 (0.76) GPR52S1PR4S1PR5MRGPRX4
SCHEMBL1852957 0.90 GPR52 (0.64) GPR52S1PR4S1PR5MRGPRX4MAPT
SCHEMBL3223155 0.87 GPR52 (0.63) GPR52S1PR4S1PR5MRGPRX4IGF1R
SCHEMBL3219557 0.87 GPR52 (0.61) GPR52MRGPRX4MAPT
SCHEMBL3212807 0.85 GPR52 (0.74) GPR52S1PR4S1PR5MRGPRX4
SCHEMBL3217505 0.84 MAOB (0.52) GPR52S1PR4S1PR5MRGPRX4IGF1R
SCHEMBL1858166 0.83 GPR52 (0.56) GPR52S1PR4S1PR5MRGPRX4IGF1R
SCHEMBL3213544 0.83 GPR52 (0.46) GPR52S1PR4S1PR5MRGPRX4IGF1R
SCHEMBL3209960 0.80 GPR52 (0.64) GPR52S1PR4S1PR5MRGPRX4HDAC4

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
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 1/4885S1PR4 565/4885S1PR5 696/4885

“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.