SCHEMBL2156302

SCHEMBL2156302

COC(=O)c1cc2c(s1)c(C1CCCCC1)c(Br)n2C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.35
UCHL1 P09936 1/20 0.35
EPHX1 P07099 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NR1H2 P55055 2/20 0.32
CYP1A2 P05177 1/20 0.32
EPHX2 P34913 1/20 0.32
EED O75530 1/20 0.32
RBBP4 Q09028 1/20 0.32
SUZ12 Q15022 1/20 0.32
EZH2 Q15910 1/20 0.32
AEBP2 Q6ZN18 1/20 0.32
PDE4B Q07343 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
OPRK1 P41145 1/20 0.31
NR1H4 Q96RI1 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
SCHEMBL5230440 0.93 KDM4E (0.31) USP30UCHL1EPHX1NR1H2PDE4B
SCHEMBL2156912 0.83 NR1H4 (0.31) USP30UCHL1ALDH1A1MEN1KMT2A
SCHEMBL2986521 0.82 NR1H2 (0.36) USP30ALDH1A1MEN1KMT2ANR1H2
SCHEMBL2157499 0.79 KDM4E (0.34) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL2156661 0.79 ALDH1A1 (0.34) ALDH1A1MEN1KMT2ACYP1A2KDM4E
SCHEMBL5443997 0.78 ALDH1A1 (0.39) USP30UCHL1ALDH1A1KDM4EMAPT
SCHEMBL2157156 0.78 KDM4E (0.35) ALDH1A1MEN1KMT2ACYP1A2KDM4E
SCHEMBL2998153 0.77 PIM1 (0.37) USP30UCHL1EPHX1ALDH1A1MEN1
SCHEMBL2156309 0.75 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ANR1H2KDM4E
SCHEMBL2157086 0.72 KDM4E (0.35) ALDH1A1MEN1KMT2AKDM4EMAPT

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 5 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-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 US disclosed
US-20090105227-A1 Thienopyrroles As Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-04-23 US disclosed
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 US disclosed
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 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 (2 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 USP30 4334/4885UCHL1 4772/4885EPHX1 1697/4885
US-20090036443-A1 Thienopyrroles as antiviral agents ZC3HAV1, XDH, TPMT USP30 4586/4885UCHL1 4778/4885EPHX1 493/4885

“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.