SCHEMBL3596677

SCHEMBL3596677

CN(C)C1Cc2cccc(N)c2NC1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 4/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
HTR1A P08908 6/20 0.33
DRD2 P14416 2/20 0.33
DRD3 P35462 1/20 0.33
HTR5A P47898 3/20 0.33
DDB1 Q16531 3/20 0.32

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
SCHEMBL3599588 0.84 HTR1A (0.36) HTR1ADRD2DRD3
SCHEMBL3594041 0.84 HTR1A (0.34) CRBNHTR1ADRD2DRD3DDB1
SCHEMBL3593971 0.83 TRPV1 (0.38) CRBNHTR1ADRD2DRD3DDB1
SCHEMBL3597335 0.83 CRBN (0.37) CRBNHTR1ADRD2DRD3DDB1
SCHEMBL3596675 0.82 BRD4 (0.33) CRBNBRD4CREBBPHTR1ADRD2
SCHEMBL3594033 0.81 TRPV1 (0.40) CRBNHTR1ADRD2DRD3HTR5A
SCHEMBL14550569 0.80 ACHE (0.40) CRBNBRD4CREBBPDRD2HTR5A
SCHEMBL13007381 0.78 ANPEP (0.40) CRBNBRD4CREBBPHTR1ADRD2
Hydrochloric Acid SCHEMBL2841681 0.76 ANPEP (0.42) CRBNBRD4CREBBPHTR1A
SCHEMBL3593980 0.76 HTR5A (0.35) CRBNBRD4CREBBPHTR1AHTR5A

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
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
WO-1990015058-A1 HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY THE UPJOHN COMPANY (US) 1990-12-13 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 CRBN 762/4885BRD4 706/4885CREBBP 2015/4885

“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.