SCHEMBL2157328

SCHEMBL2157328

COC(=O)Cn1c(-c2ccccc2C=O)c(C2CCCCC2)c2sc(C(=O)OC(C)(C)C)cc21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CDK1 P06493 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP2D6 P10635 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2156279 0.93 CYP2D6 (0.34) KDM4ETSHRHSD17B10CDK1MAPT
SCHEMBL2156720 0.90 KDM4E (0.37) KDM4ETSHRHSD17B10MAPTSMN1; SMN2
SCHEMBL2157334 0.83 ALDH1A1 (0.35) KDM4ETSHRHSD17B10CDK1MAPT
SCHEMBL2162790 0.82 KDM4E (0.32) KDM4ETSHRHSD17B10CDK1SMN1; SMN2
SCHEMBL2996273 0.80 SCN9A (0.38) KDM4ETSHRHSD17B10CYP2D6
SCHEMBL2157499 0.80 KDM4E (0.34) KDM4ETSHRHSD17B10MAPTSMN1; SMN2
SCHEMBL2157396 0.80 NR1I3 (0.34) KDM4E
SCHEMBL2998707 0.80 KDM4E (0.36) KDM4EMAPTSMN1; SMN2KMT2A
SCHEMBL2156465 0.79 KDM4E (0.34) KDM4ETSHRHSD17B10KMT2A
SCHEMBL3095427 0.79 PRKCA (0.38) KDM4ESMN1; SMN2CYP2D6

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-7973026-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-07-05 US disclosed
US-20090105227-A1 Thienopyrroles As Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-04-23 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-20090105227-A1 Thienopyrroles As Antiviral Agents ZC3HAV1, HAVCR2, ZC3HAV1L KDM4E 3275/4885TSHR 118/4885HSD17B10 2452/4885

“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.