SCHEMBL2156373

SCHEMBL2156373

CCN(CC)CCNCc1ccsc1-c1c(-c2ccccc2)c2sc(C(=O)OC)cc2n1CC(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.34
MEN1 O00255 6/20 0.34
HTT P42858 2/20 0.33
KDM4E B2RXH2 3/20 0.33
UBE2N P61088 1/20 0.32
MAPK1 P28482 1/20 0.32
THRB P10828 2/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 3/20 0.31
LMNA P02545 2/20 0.31
HDAC1 Q13547 1/20 0.31
MITF O75030 1/20 0.31
TOP2A P11388 1/20 0.31
TOP2B Q02880 1/20 0.31
NSD2 O96028 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 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
SCHEMBL2156369 0.84 KDM4E (0.32) KDM4E
SCHEMBL2156471 0.80 KDM4E (0.36) KMT2AMEN1KDM4EMAPK1THRB
SCHEMBL2157158 0.73 KDM4E (0.42) KMT2AMEN1HTTKDM4EMAPT
SCHEMBL2156282 0.72 ALDH1A1 (0.37) KMT2AMEN1HTTKDM4EMAPK1
SCHEMBL2994395 0.71 KDM4E (0.47) KMT2AMEN1KDM4EMAPTALDH1A1
SCHEMBL2998711 0.71 ALDH1A1 (0.42) KMT2AKDM4EMAPK1MAPTALDH1A1
SCHEMBL2157091 0.68 KDM4E (0.43) KMT2AMEN1HTTKDM4EMAPT
SCHEMBL2998829 0.67 KMT2A (0.40) KMT2AMEN1KDM4EMAPK1MAPT
SCHEMBL2988628 0.66 KDM4E (0.38) KMT2AMEN1KDM4EMAPTALDH1A1
SCHEMBL2157334 0.66 ALDH1A1 (0.35) KMT2AMEN1HTTKDM4EMAPT

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 KMT2A 3202/4885MEN1 4599/4885HTT 2028/4885

“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.