SCHEMBL2156333

SCHEMBL2156333

C=CCn1c(-c2ccccc2C=C)c(C2CCCCC2)c2sc(C(=O)OC)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
ALOX15 P16050 1/20 0.38
HPGD P15428 7/20 0.36
KDM4E B2RXH2 6/20 0.36
GRK6 P43250 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 3/20 0.34
TSHR P16473 4/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GLA P06280 2/20 0.33
GAA P10253 2/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NR1H4 Q96RI1 1/20 0.32
HTT P42858 1/20 0.31
PDE4D Q08499 1/20 0.31

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 0.83 CYP2D6 (0.34) ALDH1A1HPGDKDM4ESMN1; SMN2MAPT
SCHEMBL2156338 0.82 ALDH1A1 (0.41) ALDH1A1ALOX15HPGDKDM4EGRK6
SCHEMBL3583062 0.82 PRKCA (0.41) ALDH1A1HPGDKDM4EGRK6SMN1; SMN2
SCHEMBL2157328 0.77 KDM4E (0.31) KDM4ESMN1; SMN2MAPTTSHRHSD17B10
SCHEMBL2157791 0.77 KDM4E (0.39) ALDH1A1HPGDKDM4EMAPTTSHR
SCHEMBL3589949 0.76 PRKCA (0.40) ALDH1A1HPGDKDM4ESMN1; SMN2MAPT
SCHEMBL2998826 0.75 KDM4E (0.36) ALDH1A1HPGDKDM4ESMN1; SMN2MAPT
SCHEMBL2994392 0.75 KDM4E (0.40) ALDH1A1HPGDKDM4ESMN1; SMN2MAPT
SCHEMBL27713477 0.75 PRKCA (0.40) ALDH1A1HPGDKDM4ESMN1; SMN2ATM
SCHEMBL3091875 0.73 PRKCA (0.40) ALDH1A1ALOX15HPGDKDM4ESMN1; SMN2

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 ALDH1A1 433/4885ALOX15 2276/4885HPGD 1422/4885

“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.