SCHEMBL1920999

SCHEMBL1920999

CCOC(=O)c1[nH]c2c(Cl)cncc2c1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
KDM4E B2RXH2 4/20 0.51
HPGD P15428 4/20 0.51
GAA P10253 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MAPT P10636 2/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HTT P42858 1/20 0.43
RECQL P46063 1/20 0.43
ALOX15 P16050 7/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38

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
SCHEMBL1920860 0.84 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDGAANPSR1
SCHEMBL8542024 0.77 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDGAANPSR1
SCHEMBL1920782 0.75 KDM4E (0.64) ALDH1A1KDM4EHPGDGAANPSR1
SCHEMBL14174311 0.72 ALOX15 (0.70) ALDH1A1KDM4EHPGDGAANPSR1
SCHEMBL2562209 0.72 KDM4E (0.52) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL1920940 0.70 MAPT (0.48) ALDH1A1KDM4EHPGDMAPTSMN1; SMN2
SCHEMBL7056273 0.70 CYP2C9 (0.50) ALDH1A1KDM4EHPGDGAANPSR1
SCHEMBL13758172 0.69 ALDH1A1 (0.76) ALDH1A1KDM4EHPGDGAANPSR1
SCHEMBL2321306 0.69 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDNPSR1MAPT
SCHEMBL1920851 0.69 KDM4E (0.44) ALDH1A1KDM4EHPGDGAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099796-B1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2011-06-01 EP disclosed
EP-2099796-B1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2011-06-01 EP disclosed
US-7855216-B2 Aza-indolyl compounds and methods of use GENENTECH, INC. (US) 2010-12-21 US disclosed
US-7855216-B2 Aza-indolyl compounds and methods of use GENENTECH, INC. (US) 2010-12-21 US disclosed
US-7855216-B2 Aza-indolyl compounds and methods of use GENENTECH, INC. (US) 2010-12-21 US disclosed
EP-2099796-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2009-09-16 EP disclosed
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2008-10-02 US disclosed
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2008-10-02 US disclosed
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2008-10-02 US disclosed
WO-2008067481-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2008-06-05 WO disclosed
WO-2008067481-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2008-06-05 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 (1 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-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE CDKN1A, MKI67, CCNI ALDH1A1 1224/4885KDM4E 270/4885HPGD 443/4885

“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.