SCHEMBL7068328

SCHEMBL7068328

c1ccn(CCN2CCOCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
KEAP1 Q14145 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.46
KDM1A O60341 4/20 0.46
POLB P06746 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
GLA P06280 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
ATM Q13315 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
SCHEMBL3065336 0.89 KEAP1 (0.52) ALDH1A1KEAP1SMN1; SMN2KDM4EKDM1A
SCHEMBL28123666 0.81 ALDH1A1 (0.41) ALDH1A1KEAP1SMN1; SMN2KDM1APOLB
SCHEMBL235080 0.79 KDM4E (0.65) ALDH1A1KEAP1SMN1; SMN2KDM4EPOLB
SCHEMBL26462643 0.78 HRH3 (0.46) ALDH1A1POLBSIGMAR1KMT2AMAPT
SCHEMBL7769654 0.77 ATM (0.46) ALDH1A1KEAP1SMN1; SMN2KDM4EKDM1A
SCHEMBL10913328 0.76 KDM4E (0.70) ALDH1A1KEAP1SMN1; SMN2KDM4EPOLB
SCHEMBL11856358 0.76 KDM4E (0.70) ALDH1A1KEAP1SMN1; SMN2KDM4EPOLB
SCHEMBL592806 0.74 KDM1A (0.47) ALDH1A1SMN1; SMN2KDM1APOLBSIGMAR1
SCHEMBL4758301 0.73 TBXAS1 (0.50) ALDH1A1KEAP1SMN1; SMN2KDM4E
SCHEMBL1456338 0.73 HTT (0.41) ALDH1A1KEAP1SMN1; SMN2KDM4EKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109195965-A The inhibitor that WDR5 protein-protein combines 普罗佩纶治疗公司 2019-01-11 CN disclosed
CN-1753668-A 1, 5-diaryl pyrrole-3-carboxamide derivatives and their use as cannabinoid receptor modulators ASTRAZENECA AB (SE) 2006-03-29 CN disclosed
US-20030199516-A1 Methods of treating infection by drug resistant bacteria GENESOFT, INC. 2003-10-23 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-20030199516-A1 Methods of treating infection by drug resistant bacteria POLI, POLN, PCNA ALDH1A1 3899/4885KEAP1 1681/4885SMN1; SMN2 4571/4885

“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.