SCHEMBL6571089

SCHEMBL6571089

CN(C)CC1=CC=C2C(=Nc3ccccc32)C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
APAF1 O14727 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
HK1 P19367 1/20 0.36
GALK1 P51570 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CDK2 P24941 3/20 0.33
SRC P12931 2/20 0.33
CTRB1 P17538 2/20 0.33
CCNE1 P24864 2/20 0.33
AHR P35869 2/20 0.33
TDP1 Q9NUW8 2/20 0.33

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
SCHEMBL6573768 0.75 MEN1 (0.41) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL1042744 0.72 MAPT (0.41) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL10559756 0.72 KDM5C (0.34) MEN1MAPTKMT2ACDK2SRC
SCHEMBL8095449 0.71 TDP1 (0.36) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL9302961 0.70 MAPT (0.40) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL2012366 0.69 IDO1 (0.37) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL28746696 0.69 MAPT (0.39) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL9303152 0.69 MAPT (0.39) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL31087892 0.69 CDK2 (0.34) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL29420631 0.68 GSK3A (0.39) ALDH1A1MEN1MAPTKMT2AKDM4E

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
EP-1355881-A4 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMA (IL) 2004-03-31 EP claimed
EP-1355881-A2 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2003-10-29 EP claimed
US-20020115707-A1 Process for preparing pure ondansetron hydrochloride dihydrate TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-08-22 US claimed
WO-2002055492-A2 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-07-18 WO claimed
CN-101045704-A An improved process for preparing pure ondansetron hydrochloride dihydrate TEVA PHARMA (IL) 2007-10-03 CN disclosed
CN-1496350-A Improved process for preparing pure ondansetron hydrochloride dihydrate ������ҩ��ҵ���޹�˾ 2004-05-12 CN disclosed
EP-1355881-A4 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMA (IL) 2004-03-31 EP disclosed
EP-1355881-A4 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMA (IL) 2004-03-31 EP disclosed
EP-1355881-A2 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2003-10-29 EP disclosed
EP-1355881-A2 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2003-10-29 EP disclosed
WO-2002055492-A3 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMA (IL) 2003-02-13 WO disclosed
US-20020115707-A1 Process for preparing pure ondansetron hydrochloride dihydrate TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-08-22 US disclosed
US-20020115707-A1 Process for preparing pure ondansetron hydrochloride dihydrate TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-08-22 US disclosed
WO-2002055492-A2 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-07-18 WO disclosed
WO-2002055492-A2 AN IMPROVED PROCESS FOR PREPARING PURE ONDANSETRON HYDROCHLORIDE DIHYDRATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-07-18 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-20020115707-A1 Process for preparing pure ondansetron hydrochloride dihydrate HTR4, DRD4, MLN ALDH1A1 2498/4885MEN1 1830/4885MAPT 4037/4885

“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.