SCHEMBL3057249

SCHEMBL3057249

CCN(C(=O)OC(C)(C)C)c1ccc(Oc2ccc3c(c2)cc(C(=O)N2CCN(Cc4ccc5c(c4)OCO5)CC2)n3C)nc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
USP2 O75604 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
STAT3 P40763 13/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
MAPK10 P53779 1/20 0.43
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL3055087 0.89 STAT3 (0.47) STAT3
Bromide SCHEMBL3067802 0.86 STAT3 (0.51) HPGDUSP2MEN1KMT2ASTAT3
SCHEMBL3054478 0.85 USP2 (0.48) HPGDUSP2MEN1KMT2AALDH1A1
Bromide SCHEMBL3052222 0.85 STAT3 (0.49) STAT3
SCHEMBL10180502 0.84 STAT3 (0.53) HPGDUSP2STAT3
Bromide SCHEMBL3060170 0.84 MEN1 (0.43) HPGDUSP2MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL3062329 0.84 STAT3 (0.48) HPGDUSP2ALDH1A1LMNASTAT3
SCHEMBL3067044 0.84 HPGD (0.48) HPGDUSP2MEN1KMT2AALDH1A1
Bromide SCHEMBL3065084 0.84 STAT3 (0.53) HPGDUSP2STAT3
SCHEMBL10180854 0.84 MEN1 (0.49) HPGDUSP2MEN1KMT2AALDH1A1

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-8551999-B2 Heterocyclic compound and pharmaceutical composition thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-10-08 US disclosed
EP-2207773-B1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMA CO LTD (JP) 2012-07-11 EP disclosed
US-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-10-14 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-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF COL1A1, COL2A1, COL14A1 HPGD 263/4885USP2 4723/4885MEN1 275/4885

“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.