SCHEMBL3329830

SCHEMBL3329830

Cc1ccc(-n2c(=O)[nH]c3c(C(N)=O)nc(-c4cccnc4F)nc32)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.64
▸ KMT2A Q03164 5/20 0.64
▸ HPGD P15428 4/20 0.64
▸ ALDH1A1 P00352 3/20 0.64
▸ MEN1 O00255 3/20 0.64
▸ RXFP1 Q9HBX9 2/20 0.64
▸ CSNK2A1 P68400 5/20 0.62
▸ HSD17B10 Q99714 7/20 0.61
▸ USP2 O75604 4/20 0.61
▸ MAPT P10636 1/20 0.61
▸ PKM P14618 1/20 0.61
▸ ALOX15 P16050 1/20 0.61
▸ XBP1 P17861 1/20 0.61
▸ TSHR P16473 3/20 0.61
▸ LMNA P02545 2/20 0.61
▸ NPSR1 Q6W5P4 4/20 0.58
▸ GAA P10253 4/20 0.58
▸ MAPK1 P28482 2/20 0.58
▸ BRCA1 P38398 2/20 0.58
▸ TP53 P04637 1/20 0.58

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
SCHEMBL11939089 0.85 CSNK2A1 (0.67) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL3333973 0.81 CSNK2A1 (0.84) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL291505 0.80 KDM4E (0.68) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL11940597 0.80 CSNK2A1 (0.79) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL3334412 0.79 CSNK2A1 (0.66) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL291750 0.79 KDM4E (0.69) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL3333345 0.78 CSNK2A1 (0.64) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL12288530 0.78 CSNK2A1 (0.68) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL3333434 0.77 CSNK2A1 (0.60) KDM4EKMT2AHPGDALDH1A1MEN1
SCHEMBL3331873 0.77 CSNK2A1 (0.67) KDM4EKMT2AHPGDALDH1A1MEN1

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-20120302565-A1 KINASE INHIBITORS FOR PREVENTING OR TREATING PATHOGEN INFECTION AND METHOD OF USE THEREOF M.D. ANDERSON CANCER CENTER (US) 2012-11-29 — — US disclosed
US-8268809-B2 Kinase inhibitors for preventing or treating pathogen infection and method of use thereof EMORY UNIVERSITY (US) 2012-09-18 — — US disclosed
US-8268809-B2 Kinase inhibitors for preventing or treating pathogen infection and method of use thereof EMORY UNIVERSITY (US) 2012-09-18 — — US disclosed
US-20100249122-A1 Kinase Inhibitors for Preventing or Treating Pathogen Infection and Method of Use Thereof EMORY UNIVERSITY (US) 2010-09-30 — — US disclosed
US-20100249122-A1 Kinase Inhibitors for Preventing or Treating Pathogen Infection and Method of Use Thereof EMORY UNIVERSITY (US) 2010-09-30 — — US disclosed
US-20100144738-A1 INHIBITORS OF C-MET AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2010-06-10 — — US disclosed
US-20100144738-A1 INHIBITORS OF C-MET AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2010-06-10 — — US disclosed
US-20100144738-A1 INHIBITORS OF C-MET AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2010-06-10 — — US disclosed
WO-2008030744-A2 INHIBITORS OF C-MET AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-03-13 — — WO disclosed
WO-2008030744-A2 INHIBITORS OF C-MET AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-03-13 — — 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 (3 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-20100249122-A1 Kinase Inhibitors for Preventing or Treating Pathogen Infection and Method of Use Thereof MAP3K1, MAP3K2, MAP3K6 KDM4E 1924/4885KMT2A 1524/4885HPGD 3665/4885
US-20100144738-A1 INHIBITORS OF C-MET AND USES THEREOF MET, HGF, HGFAC KDM4E 1415/4885KMT2A 1909/4885HPGD 3888/4885
US-20120302565-A1 KINASE INHIBITORS FOR PREVENTING OR TREATING PATHOGEN INFECTION AND METHOD OF USE THEREOF MAP3K1, MAP3K2, MAP3K6 KDM4E 1924/4885KMT2A 1524/4885HPGD 3665/4885

“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.

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