SCHEMBL7092075

SCHEMBL7092075

CC(CCN)c1nc2cccnc2c2c1ncn2CCNC(=O)C1=NC(=O)CC1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 3/20 0.32
PSMB1 P20618 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GLA P06280 2/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
BLM P54132 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
APAF1 O14727 1/20 0.31
USP2 O75604 1/20 0.31
NSD2 O96028 1/20 0.31
LMNA P02545 1/20 0.31
XBP1 P17861 1/20 0.31
CASP1 P29466 1/20 0.31
HTT P42858 1/20 0.31
CASP7 P55210 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL7095098 0.80 LARS1 (0.32) PSMB5PSMB1KDM4EALDH1A1GLA
SCHEMBL6924182 0.80 MAOB (0.34) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL22006150 0.78 PSMB5 (0.38) PSMB5PSMB1ALDH1A1GAAHPGD
SCHEMBL8150493 0.77 TLR8 (0.37) HTT
SCHEMBL6441603 0.76 HSP90AA1 (0.36) KDM4EALDH1A1LMNACASP1CASP7
SCHEMBL6642504 0.76 HDAC4 (0.35) KDM4EALDH1A1CASP1HTTCASP7
SCHEMBL20865570 0.75 DPP7 (0.32) PSMB5PSMB1KDM4EUSP2CASP1
SCHEMBL18546822 0.74 EPHX1 (0.38) ALDH1A1MAPT
SCHEMBL6640299 0.73 SHMT2 (0.37) PSMB5KDM4EALDH1A1MAPTNPSR1
SCHEMBL18214190 0.69 TLR7 (0.42) KDM4EALDH1A1GLAGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212093-A1 Viricides, antitumor agents 3M INNOVATIVE PROPERTIES COMPANY 2003-11-13 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-20030212093-A1 Viricides, antitumor agents IFNG, IFNAR1, MAVS PSMB5 3316/4885PSMB1 3165/4885KDM4E 4303/4885

“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.