SCHEMBL3206749

SCHEMBL3206749

CCOC(=O)c1cccc(-c2cccc3cc(Cc4cccn(C)c4=O)sc23)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 4/20 0.43
PRKDC P78527 1/20 0.40
PIK3CA P42336 1/20 0.39
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
EIF4H Q15056 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
S1PR4 O95977 1/20 0.38
S1PR5 Q9H228 1/20 0.38
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL1856138 0.97 GPR52 (0.41) GPR52PRKDCPIK3CATP53POLB
SCHEMBL1851263 0.88 S1PR5 (0.43) GPR52S1PR4S1PR5
SCHEMBL3204381 0.84 GPR52 (0.49) GPR52PRKDCPIK3CATP53POLB
SCHEMBL1870417 0.82 GPR52 (0.60) GPR52S1PR4S1PR5
SCHEMBL3196519 0.82 GPR52 (0.47) GPR52PRKDCTP53POLBHPGD
SCHEMBL3196486 0.81 GPR52 (0.46) GPR52PRKDCPIK3CATP53POLB
SCHEMBL1848922 0.80 GPR52 (0.46) GPR52PRKDCTP53POLBHPGD
SCHEMBL1852050 0.80 GPR52 (0.47) GPR52PRKDCPIK3CATP53POLB
SCHEMBL3213279 0.79 GPR52 (0.51) GPR52PRKDCPIK3CAS1PR4S1PR5
SCHEMBL1848859 0.79 GPR52 (0.46) GPR52TP53POLBHPGDS1PR4

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 1/4885PRKDC 4721/4885PIK3CA 4436/4885

“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.