SCHEMBL2998031

SCHEMBL2998031

COC(=O)Cc1cc(Cl)nc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
MAPT P10636 6/20 0.50
ALDH1A1 P00352 5/20 0.50
POLB P06746 1/20 0.50
NPC1 O15118 1/20 0.50
HTT P42858 3/20 0.49
USP2 O75604 1/20 0.49
KMT2A Q03164 3/20 0.48
IGF1R P08069 2/20 0.48
ACACA Q13085 1/20 0.48
MEN1 O00255 2/20 0.47
GAA P10253 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HPGD P15428 2/20 0.45
AHR P35869 1/20 0.45

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
SCHEMBL30964777 1.00 KDM4E (0.61) KDM4EMAPTALDH1A1POLBNPC1
SCHEMBL30979649 0.83 KDM4E (0.53) KDM4EMAPTALDH1A1POLBHTT
SCHEMBL27507138 0.83 KDM4E (0.53) KDM4EMAPTALDH1A1POLBHTT
SCHEMBL6174942 0.82 KDM4E (0.47) KDM4EMAPTALDH1A1POLBNPC1
SCHEMBL15919425 0.82 ACACA (0.48) KDM4EMAPTALDH1A1NPC1HTT
SCHEMBL2998020 0.80 KDM4E (0.50) KDM4EMAPTALDH1A1POLBHTT
SCHEMBL13576841 0.78 ACLY (0.47) KDM4EMAPTALDH1A1KMT2AMEN1
SCHEMBL5910669 0.77 KDM4E (0.53) KDM4EMAPTALDH1A1POLBNPC1
SCHEMBL5235583 0.76 KDM5A (0.48) KDM4EMAPTALDH1A1HTTUSP2
SCHEMBL15919413 0.76 TP53 (0.56) KDM4EMAPTALDH1A1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825124-B2 Indolylmaleimide derivatives ALBERT RAINER 2010-11-02 US disclosed
US-7786123-B2 Indolylmaleimide derivatives ALBERT RAINER 2010-08-31 US disclosed
US-20090318463-A1 Indolylmaleimide Derivatives ALBERT RAINER 2009-12-24 US disclosed
EP-1337527-B1 INDOLYLMALEIMIDE DERIVATIVES AS PROTEIN KINASE C INHIBITORS NOVARTIS AG (CH) 2009-10-14 EP disclosed
EP-2070921-A1 Indolylmaleimide derivatives as protein kinase c inhibitors Novartis Ag (CH) 2009-06-17 EP disclosed
US-20070191401-A1 Transplant rejection, autoimmune disease, autoimmune disease ALBERT RAINER 2007-08-16 US disclosed
US-20070184061-A1 Indolylmaleimide derivatives ALBERT RAINER 2007-08-09 US disclosed
US-20070155817-A1 Indolylmaleimide derivatives ALBERT RAINER 2007-07-05 US disclosed
US-7220774-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2007-05-22 US disclosed
US-20040053949-A1 Indolylmaleimide derivatives ALBERT RAINER (CH) 2004-03-18 US disclosed
US-6645970-B2 Preventing T-cell mediated acute or chronic inflammatory diseases or disorders, autoimmune diseases, graft rejection or cancer NOVARTIS AG (CH) 2003-11-11 US disclosed
EP-1337527-A1 INDOLYLMALEIMIDE DERIVATIVES AS PROTEIN KINASE C INHIBITORS Novartis AG (CH) 2003-08-27 EP disclosed
US-20030069424-A1 Indolylmaleimide derivatives NOVARTIS AG (CH) 2003-04-10 US disclosed
WO-2002038561-A1 INDOLYLMALEIMIDE DERIVATIVES AS PROTEIN KINASE C INHIBITORS NOVARTIS AG (CH) 2002-05-16 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 (6 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-20090318463-A1 Indolylmaleimide Derivatives NFATC1, INMT, IDO1 KDM4E 404/4885MAPT 2909/4885ALDH1A1 1752/4885
US-20070191401-A1 Transplant rejection, autoimmune disease, autoimmune disease NFATC1, HLA-DRB1, INMT KDM4E 832/4885MAPT 3568/4885ALDH1A1 1866/4885
US-20030069424-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 KDM4E 404/4885MAPT 2909/4885ALDH1A1 1752/4885
US-20040053949-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 KDM4E 404/4885MAPT 2909/4885ALDH1A1 1752/4885
US-20070155817-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 KDM4E 404/4885MAPT 2909/4885ALDH1A1 1752/4885
US-20070184061-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 KDM4E 404/4885MAPT 2909/4885ALDH1A1 1752/4885

“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.