SCHEMBL1996892

SCHEMBL1996892

CN1CCN(c2cc(CC(N)=O)c3ccccc3n2)CC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 5/20 0.62
KMT2A Q03164 2/20 0.60
ALDH1A1 P00352 4/20 0.59
KDM4E B2RXH2 3/20 0.59
MEN1 O00255 1/20 0.59
USP2 O75604 1/20 0.59
PKM P14618 1/20 0.59
HRH4 Q9H3N8 2/20 0.50
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
HPGD P15428 1/20 0.49
ALOX12 P18054 1/20 0.49
NCF1 P14598 1/20 0.49

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
SCHEMBL1996700 0.85 KDM4E (0.66) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL5910624 0.84 KMT2A (0.69) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL1992970 0.82 KMT2A (0.56) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL2990496 0.80 HTR3A (0.61) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL28455263 0.79 KDM4E (0.75) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL1993681 0.78 HRH4 (0.61) HTR3AALDH1A1KDM4EHRH4NCF1
SCHEMBL5910851 0.77 HTR3A (1.00) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL5910282 0.76 KMT2A (1.00) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL28538954 0.75 KDM4E (0.98) HTR3AKMT2AALDH1A1KDM4EMEN1
SCHEMBL1993011 0.74 KMT2A (0.71) HTR3AKMT2AALDH1A1KDM4EMEN1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-23 US disclosed
US-7825124-B2 Indolylmaleimide derivatives ALBERT RAINER 2010-11-02 US disclosed
US-7825124-B2 Indolylmaleimide derivatives ALBERT RAINER 2010-11-02 US disclosed
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-7786123-B2 Indolylmaleimide derivatives ALBERT RAINER 2010-08-31 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
US-20090318463-A1 Indolylmaleimide Derivatives ALBERT RAINER 2009-12-24 US disclosed
US-20090318463-A1 Indolylmaleimide Derivatives ALBERT RAINER 2009-12-24 US disclosed
US-7220774-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2007-05-22 US disclosed
US-7220774-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2007-05-22 US disclosed
US-7220774-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2007-05-22 US disclosed
CN-1253449-C indolylmaleimide derivatives as protein kinase C inhibitors NOVARTIS AG (CH) 2006-04-26 CN disclosed
US-20040053949-A1 Indolylmaleimide derivatives ALBERT RAINER (CH) 2004-03-18 US disclosed
CN-1478087-A Indolylmaleimide derivatives as protein kinase C inibitors ��˹��ŵ�� 2004-02-25 CN 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 (4 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 HTR3A 938/4885KMT2A 1593/4885ALDH1A1 1752/4885
US-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS TPMT, TSLP, THPO HTR3A 1075/4885KMT2A 3648/4885ALDH1A1 297/4885
US-20030069424-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 HTR3A 938/4885KMT2A 1593/4885ALDH1A1 1752/4885
US-20040053949-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 HTR3A 938/4885KMT2A 1593/4885ALDH1A1 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.