SCHEMBL4078736

SCHEMBL4078736

Cc1ccc2cc(CN(C(C)C)S(=O)(=O)c3ccc4c(c3)OCCN4C)c(=O)[nH]c2c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.47
RXFP1 Q9HBX9 4/20 0.47
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 10/20 0.46
ALDH1A1 P00352 8/20 0.46
MAPT P10636 2/20 0.46
HSD17B10 Q99714 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL4072993 0.93 KDM4E (0.53) RXFP1KMT2AKDM4EALDH1A1MAPT
SCHEMBL4072846 0.90 KDM4E (0.46) KMT2AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL4072879 0.89 ALDH1A1 (0.50) KMT2AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL5444484 0.86 ALDH1A1 (0.53) RXFP1KMT2AKDM4EALDH1A1MAPT
SCHEMBL4075260 0.86 HSD17B10 (0.53) KDM4EALDH1A1MAPTHSD17B10NPSR1
SCHEMBL4075936 0.84 KDM4E (0.55) KMT2AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL5455857 0.82 ALDH1A1 (0.45) KMT2AKDM4EALDH1A1MAPTHSD17B10
SCHEMBL4069803 0.82 KDM4E (0.44) GBA1RXFP1KMT2AKDM4EALDH1A1
SCHEMBL4069801 0.82 KDM4E (0.44) GBA1RXFP1KMT2AKDM4EALDH1A1
SCHEMBL4069807 0.82 KDM4E (0.44) GBA1RXFP1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2040711-A2 2-OXO-1,2-DIHYDROQUINOLINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS Amphora Discovery Corporation (US) 2009-04-01 EP claimed
US-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 US claimed
WO-2007136592-A2 2-0X0-L,2-DIHYDR0QUIN0LINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS AMPHORA DISCOVERY CORPORATION (US) 2007-11-29 WO claimed
US-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 US 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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof ABCG2, ATP5ME, ATP5MG GBA1 748/4885RXFP1 4602/4885KMT2A 2810/4885

“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.