SCHEMBL2157158

SCHEMBL2157158

COC(=O)Cn1c(Br)c(-c2ccccc2)c2sc(C(=O)OC)cc21

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
GLA P06280 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RCE1 Q9Y256 1/20 0.40
MAPK8 P45983 3/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 1/20 0.38
AR P10275 1/20 0.38
TSHR P16473 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL2157091 0.94 KDM4E (0.43) KDM4ESMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL2156914 0.91 ALDH1A1 (0.39) KDM4ESMN1; SMN2KMT2AALDH1A1HSD17B10
SCHEMBL2157504 0.91 KDM4E (0.39) KDM4ESMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL2156666 0.87 KMT2A (0.39) KDM4ESMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL2156282 0.79 ALDH1A1 (0.37) KDM4ESMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL2998711 0.79 ALDH1A1 (0.42) KDM4ESMN1; SMN2KMT2AALDH1A1HSD17B10
SCHEMBL2994395 0.79 KDM4E (0.47) KDM4ESMN1; SMN2KMT2AALDH1A1MEN1
SCHEMBL2156471 0.77 KDM4E (0.36) KDM4ESMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL2998829 0.77 KMT2A (0.40) KDM4ESMN1; SMN2KMT2AALDH1A1GAA
SCHEMBL2156309 0.76 ALDH1A1 (0.43) KDM4EKMT2AALDH1A1GAAMEN1

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 3275/4885SMN1; SMN2 4123/4885KMT2A 3202/4885

“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.