SCHEMBL3596211

SCHEMBL3596211

Cc1cn2cc(CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)ncc2n1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.35
GRM1 Q13255 1/20 0.35
RXRA P19793 4/20 0.32
GRIN1 Q05586 4/20 0.32
GRIN2B Q13224 4/20 0.32
RAB9A P51151 4/20 0.32
KDM4E B2RXH2 3/20 0.32
MAPT P10636 2/20 0.32
GAA P10253 1/20 0.32
PDE10A Q9Y233 2/20 0.31
NPC1 O15118 3/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
TSHR P16473 1/20 0.31
HPGD P15428 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30

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
SCHEMBL26092925 0.82 KDM4E (0.47) RAB9AKDM4EMAPTGAANPC1
SCHEMBL9174404 0.74 SMN1; SMN2 (0.42) RAB9ANPC1OPRM1SMN1; SMN2
SCHEMBL17611621 0.73 CYP1A2 (0.43) GRM5GRM1PDE10A
SCHEMBL3593068 0.73 ALDH1A1 (0.41) GRM5GRM1RAB9AKDM4EMAPT
SCHEMBL3598198 0.70 ALOX5AP (0.41) GRM5GRM1KDM4ESMN1; SMN2
SCHEMBL1181594 0.70 ATM (0.35) GRM5GRM1KDM4ESMN1; SMN2
SCHEMBL14151703 0.69 SMYD2 (0.39) GRM5GRM1SMN1; SMN2
SCHEMBL3248397 0.69 UHRF1 (0.37) GRM5GRM1RAB9AMAPTNPC1
SCHEMBL2226551 0.69 PDE10A (0.41) GRM5GRM1RAB9AKDM4EMAPT
SCHEMBL10038834 0.69 NOS3 (0.32) RXRAGRIN1GRIN2BKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8742132-B2 Indolylmaleimide derivatives processes for their production and pharmaceutical compositions NOVARTIS AG (CH) 2014-06-03 US disclosed
EP-2094689-B1 INDOLYLMALEIMIDE DERIVATIVES AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-04-03 EP disclosed
US-20120219593-A1 INDOLYLMALEIMIDE DERIVATIVES PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS NOVARTIS AG 2012-08-30 US disclosed
US-8193236-B2 Indolylmaleimide derivatives processes for their production and pharmaceutical compositions NOVARTIS AG (CH) 2012-06-05 US disclosed
US-20100041693-A1 INDOLYLMALEIMIDE DERIVATIVES NOVARTIS AG (CH) 2010-02-18 US disclosed
EP-2094689-A2 INDOLYLMALEIMIDE DERIVATIVES AS KINASE INHIBITORS Novartis AG (CH) 2009-09-02 EP disclosed
WO-2008074752-A2 INDOLYLMALEIMIDE DERIVATIVES AS KINASE INHIBITORS NOVARTIS AG (CH) 2008-06-26 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 (2 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-20120219593-A1 INDOLYLMALEIMIDE DERIVATIVES PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS RB1, INMT, IDH3A GRM5 3045/4885GRM1 2637/4885RXRA 1117/4885
US-20100041693-A1 INDOLYLMALEIMIDE DERIVATIVES IDH3A, IDH2, INMT GRM5 2444/4885GRM1 1509/4885RXRA 1073/4885

“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.