SCHEMBL3584555

SCHEMBL3584555

CN(C1CCCCC1)C1Cc2c([NH])cccc2NC1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 4/20 0.36
CRBN Q96SW2 4/20 0.36
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 3/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GAA P10253 2/20 0.32
MAPT P10636 1/20 0.32
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
CREBBP Q92793 3/20 0.31
BRD4 O60885 2/20 0.31
PARP1 P09874 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
SCHEMBL3584557 0.86 DDB1 (0.37) DDB1CRBNKMT2AMEN1KDM4E
SCHEMBL3593976 0.82 CREBBP (0.34) DDB1CRBNKDM4EALDH1A1GAA
SCHEMBL3597334 0.81 DDB1 (0.35) DDB1CRBNKMT2AMEN1KDM4E
SCHEMBL3595539 0.77 HSP90AA1 (0.36) KMT2AMEN1KDM4EALDH1A1HTT
SCHEMBL3589696 0.76 DDB1 (0.33) DDB1CRBNKMT2AMEN1GAA
SCHEMBL3597784 0.76 PDE3B (0.36) DDB1CRBNGAAMAPTPARP1
SCHEMBL3598948 0.75 HTR1A (0.34) DDB1CRBNKDM4EALDH1A1GAA
SCHEMBL3592385 0.74 TRPV1 (0.38) DDB1CRBNKDM4EALDH1A1HTT
SCHEMBL3590434 0.72 TRPV1 (0.41) DDB1CRBNKDM4EALDH1A1TSHR
SCHEMBL3597785 0.71 PDE3B (0.36) DDB1CRBNALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 DDB1 1855/4885CRBN 762/4885KMT2A 906/4885

“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.