SCHEMBL3002812

SCHEMBL3002812

Oc1cc(Br)c2c(c1)CCCC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.38
BAD Q92934 1/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAOA P21397 2/20 0.33
MAOB P27338 1/20 0.33
PRKCI P41743 1/20 0.33
ALOX5 P09917 1/20 0.32
PTGS2 P35354 1/20 0.32
CYP3A4 P08684 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31

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
SCHEMBL29383596 0.96 MAOA (0.37) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL22618607 0.96 MAOA (0.37) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL21584122 0.86 PTGS2 (0.34) ALOX5PTGS2ESR1ESR2AKT1
SCHEMBL4371875 0.86 PTGS2 (0.40) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL3675894 0.77 BCL2L1 (0.50) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL17641538 0.76 CYP3A4 (0.46) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL31127815 0.74 CHRNB4 (0.33)
SCHEMBL25802825 0.74 BCL2L1 (0.38) BCL2L1BADMEN1KMT2AKDM4E
SCHEMBL11809862 0.74 GNG2 (0.36) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL30305680 0.73 BCL2L1 (0.45) BCL2L1BADMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024167922-A2 HETEROCYCLIC COMPOUNDS AS NRAS INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-08-15 WO 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-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 BCL2L1 849/4885BAD 266/4885MEN1 1501/4885
US-20070191401-A1 Transplant rejection, autoimmune disease, autoimmune disease NFATC1, HLA-DRB1, INMT BCL2L1 941/4885BAD 217/4885MEN1 1477/4885
US-20030069424-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 BCL2L1 849/4885BAD 266/4885MEN1 1501/4885
US-20040053949-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 BCL2L1 849/4885BAD 266/4885MEN1 1501/4885
US-20070155817-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 BCL2L1 849/4885BAD 266/4885MEN1 1501/4885
US-20070184061-A1 Indolylmaleimide derivatives NFATC1, INMT, IDO1 BCL2L1 849/4885BAD 266/4885MEN1 1501/4885

“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.