SCHEMBL3143152

SCHEMBL3143152

CCC1(C)CC(=O)NCCS1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39
CYP2C19 P33261 1/20 0.39
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RUNX1 Q01196 1/20 0.35
CBFB Q13951 1/20 0.35
HIF1A Q16665 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL3133818 0.84 SMN1; SMN2 (0.33) KDM4ELMNACYP2C19SMN1; SMN2
SCHEMBL3138397 0.78 SMN1; SMN2 (0.40) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL3129311 0.78 KDM4E (0.30) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL3129133 0.69 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL7439817 0.67 KDM4E (0.59) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL7435181 0.64 KDM4E (0.40) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL1441598 0.63
SCHEMBL3138979 0.62
SCHEMBL21557294 0.62 KDM4E (0.47) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL11165943 0.62

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004221-A1 THIAZEPINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-01-07 US disclosed
EP-2119719-A1 THIAZEPINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-11-18 EP 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-20100004221-A1 THIAZEPINE DERIVATIVE HSD11B1, HSD17B1, HSD3B1 KDM4E 3556/4885LMNA 3489/4885CYP2C19 148/4885

“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.