SCHEMBL4089117

SCHEMBL4089117

CCOC(=O)Cc1cc(OCc2ccccc2)cc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 3/20 0.50
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HSP90AA1 P07900 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
LTB4R Q15722 1/20 0.47
LTB4R2 Q9NPC1 1/20 0.47
ALDH1A1 P00352 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 2/20 0.46
PKM P14618 1/20 0.45
ALOX5 P09917 2/20 0.44
AHR P35869 1/20 0.44
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
PPARA Q07869 1/20 0.44

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
SCHEMBL4083845 0.93 PRMT5 (0.48) PRMT5MEN1KMT2AHSP90AA1NR1H4
SCHEMBL5237511 0.85 ALOX5 (0.49) MEN1KMT2ALTB4RLTB4R2ALDH1A1
SCHEMBL11965263 0.81 NR1H4 (0.53) PRMT5MEN1KMT2AHSP90AA1NR1H4
SCHEMBL4075611 0.80 ALDH1A1 (0.53) MEN1KMT2AALDH1A1L3MBTL1KDM4E
SCHEMBL4852083 0.80 MEN1 (0.56) PRMT5MEN1KMT2AHSP90AA1NR1H4
SCHEMBL136449 0.79 NR1H4 (0.51) PRMT5MEN1KMT2AHSP90AA1NR1H4
SCHEMBL4078469 0.79 GAA (0.45) MEN1KMT2AALDH1A1L3MBTL1KDM4E
SCHEMBL21822345 0.79 ALOX5 (0.57) MEN1KMT2ALMNAALOX5MAOB
SCHEMBL27599866 0.78 ALDH1A1 (0.47) MEN1KMT2AHSP90AA1LTB4RLTB4R2
SCHEMBL8051693 0.77 NR1H4 (0.51) PRMT5MEN1KMT2AHSP90AA1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7534808-B2 Indolylmaleimide derivatives ELANCO TIERGESUNDHEIT AG (CH) 2009-05-19 US disclosed
US-20080146578-A1 INDOLYLMALEIMIDE DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2008-06-19 US disclosed
US-20080108628-A1 Treatment of diseases or disorders mediated by T lymphocytes and/or PKC; may be coadminstered with an immunosuppressant, immunomodulatory, anti-inflammatory, antiproliferative or anti-diabetic drug EVENOU JEAN-PIERRE 2008-05-08 US disclosed
US-7358253-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2008-04-15 US disclosed
US-7235555-B2 Indolylmaleimide derivatives NOVARTIS AG (CH) 2007-06-26 US disclosed
US-20070037826-A1 Treatment of diseases or disorders mediated by T lymphocytes and/or PKC, e.g., acute or chronic rejection of organ or tissue allo- or xenografts or graft versus host disease ELANCO TIERGESUNDHEIT AG (CH) 2007-02-15 US disclosed
US-20070032507-A1 Indolylmaleimide derivatives ELANCO TIERGESUNDHEIT AG (CH) 2007-02-08 US disclosed
US-20050119274-A1 Indolylmaleimide derivatives NOVARTIS AG (CH) 2005-06-02 US disclosed
EP-1490355-A1 INDOLYLMALEIMIDE DERIVATIVES Novartis AG (CH) 2004-12-29 EP disclosed
WO-2003082859-A1 INDOLYLMALEIMIDE DERIVATIVES NOVARTIS AG (CH) 2003-10-09 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 (5 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-20070032507-A1 Indolylmaleimide derivatives MYLK2, DGKK, LCK PRMT5 2634/4885MEN1 1307/4885KMT2A 4186/4885
US-20080108628-A1 Treatment of diseases or disorders mediated by T lymphocytes and/or PKC; may be coadminstered with an immunosuppressant, immunomodulatory, anti-inflammatory, antiproliferative or anti-diabetic drug NFATC1, CD4, LCK PRMT5 869/4885MEN1 3565/4885KMT2A 3738/4885
US-20050119274-A1 Indolylmaleimide derivatives MYLK2, DGKK, LCK PRMT5 2634/4885MEN1 1307/4885KMT2A 4186/4885
US-20080146578-A1 INDOLYLMALEIMIDE DERIVATIVES MYLK2, LCK, DGKK PRMT5 2373/4885MEN1 1469/4885KMT2A 4238/4885
US-20070037826-A1 Treatment of diseases or disorders mediated by T lymphocytes and/or PKC, e.g., acute or chronic rejection of organ or tissue allo- or xenografts or graft versus host disease DGKK, DGKG, HLA-DRB1 PRMT5 2708/4885MEN1 1035/4885KMT2A 4384/4885

“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.