SCHEMBL2461226

SCHEMBL2461226

O=C(Nc1ccc(O)cc1)c1ccc(Br)cc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.71
KDM4E B2RXH2 3/20 0.71
ALDH1A1 P00352 1/20 0.71
GAA P10253 1/20 0.71
GFER P55789 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
TDP1 Q9NUW8 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
KMT2A Q03164 5/20 0.67
MEN1 O00255 4/20 0.67
TP53 P04637 3/20 0.65
NPC1 O15118 1/20 0.65
MAPK1 P28482 1/20 0.65
RAB9A P51151 1/20 0.65
SNCA P37840 1/20 0.64
DEGS1 O15121 1/20 0.64
NQO2 P16083 2/20 0.61
USP2 O75604 1/20 0.59
POLB P06746 2/20 0.59

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
SCHEMBL3679372 0.92 KMT2A (0.76) MAPTKDM4ETDP1KMT2AMEN1
SCHEMBL21798720 0.92 KMT2A (0.76) MAPTKDM4ETDP1KMT2AMEN1
SCHEMBL899585 0.90 DEGS1 (0.75) KDM4EGAASMN1; SMN2TDP1L3MBTL1
SCHEMBL900928 0.90 DEGS1 (0.75) KDM4EGAASMN1; SMN2TDP1L3MBTL1
SCHEMBL8420639 0.90 DEGS1 (0.75) KDM4EGAASMN1; SMN2TDP1L3MBTL1
SCHEMBL674688 0.86 HDAC6 (0.69) MAPTKMT2AMEN1TP53USP2
SCHEMBL16583981 0.85 KMT2A (0.74) MAPTKDM4EKMT2AMEN1TP53
SCHEMBL16592202 0.85 KMT2A (0.74) MAPTKDM4EKMT2AMEN1TP53
SCHEMBL20284045 0.84 DEGS1 (0.86) KDM4ESMN1; SMN2TDP1KMT2AMEN1
SCHEMBL8770541 0.84 DEGS1 (0.68) MAPTKDM4ETDP1KMT2AMEN1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101035777-B HCV replication modulators ANGELETTI P IST RICHERCHE BIO 2013-01-02 CN disclosed
EP-1799663-B1 Modulators of HCV replication ANGELETTI P IST RICHERCHE BIO (IT) 2012-08-01 EP disclosed
US-8012982-B2 Modulators of HCV replication ISTITUTO DI RICERCHE BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-09-06 US disclosed
US-8012982-B2 Modulators of HCV replication ISTITUTO DI RICERCHE BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-09-06 US disclosed
US-8012982-B2 Modulators of HCV replication ISTITUTO DI RICERCHE BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-09-06 US disclosed
US-20090069344-A1 Modulators of hcv replication ISTITUTO DI RICERCHE BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-03-12 US disclosed
US-20090069344-A1 Modulators of hcv replication ISTITUTO DI RICERCHE BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-03-12 US disclosed
US-20090069344-A1 Modulators of hcv replication ISTITUTO DI RICERCHE BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-03-12 US disclosed
CN-101035777-A HCV replication modulators ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 CN disclosed
EP-1799663-A1 MODULATORS OF HCV REPLICATION Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2007-06-27 EP disclosed
WO-2006038039-A1 MODULATORS OF HCV REPLICATION ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2006-04-13 WO 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-20090069344-A1 Modulators of hcv replication EIF2AK2, IRF3, IFNAR1 MAPT 4662/4885KDM4E 2063/4885ALDH1A1 3229/4885

“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.