SCHEMBL2997767

SCHEMBL2997767

COC(=O)c1cc2cc(-c3ccccc3)n(Cc3ccccc3)c2s1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 3/20 0.47
THRB P10828 1/20 0.47
AR P10275 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MAPK8 P45983 5/20 0.45
HPGD P15428 3/20 0.44
POLB P06746 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL2987708 0.77 MAPK8 (0.51) KDM4EKMT2ASMN1; SMN2MAPTTHRB
SCHEMBL8506149 0.75 KDM4E (0.54) KDM4EKMT2ASMN1; SMN2MAPTTHRB
SCHEMBL2991427 0.74 KDM4E (0.59) KDM4EKMT2ASMN1; SMN2MAPTTHRB
SCHEMBL28370091 0.74 MAPK8 (0.55) KDM4EMAPTTHRBARALDH1A1
SCHEMBL2824148 0.72 L3MBTL1 (0.54) KMT2AALDH1A1MAPK8L3MBTL1
SCHEMBL29818887 0.72 L3MBTL1 (0.54) KMT2AALDH1A1MAPK8L3MBTL1
SCHEMBL6235401 0.72 KDM4E (0.54) KDM4EKMT2ASMN1; SMN2ALDH1A1TDP1
SCHEMBL2996795 0.71 KDM4E (0.45) KDM4EKMT2ASMN1; SMN2MAPTTHRB
SCHEMBL2827543 0.71 L3MBTL1 (0.52) KMT2AALDH1A1MAPK8L3MBTL1
SCHEMBL8504351 0.70 PLA2G2A (0.52) KDM4EKMT2ASMN1; SMN2MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 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
CN-1849323-A Thienopyrroles as antiviral agents ANGELETTI P IST RICHERCHE BIO (IT) 2006-10-18 CN 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-20090036443-A1 Thienopyrroles as antiviral agents ZC3HAV1, XDH, TPMT KDM4E 3250/4885KMT2A 3970/4885SMN1; SMN2 3684/4885

“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.