SCHEMBL3597377

SCHEMBL3597377

COCCN1Cc2cc([NH])ccc2NC1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PARP1 P09874 1/20 0.38
MAPK1 P28482 5/20 0.38
TNF P01375 2/20 0.36
HSD17B10 Q99714 2/20 0.35
ADRA1B P35368 1/20 0.35
ALOX15 P16050 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CREBBP Q92793 1/20 0.35

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
SCHEMBL3584898 0.89 ALDH1A1 (0.39) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL3597379 0.84 BRD4 (0.41) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL3588936 0.82 BRD4 (0.40) BRD4PARP1
SCHEMBL13077879 0.80 BRD4 (0.57) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL31192602 0.80 BRD4 (0.57) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL14934080 0.79 MAPK1 (0.38) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL3593647 0.76 BRD4 (0.66) BRD4CREBBP
SCHEMBL3584900 0.76 CA9 (0.43) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL3600609 0.74 ACE (0.40) BRD4ALDH1A1KDM4EGLAGAA
SCHEMBL13545267 0.74 TRPV1 (0.40) ALDH1A1KDM4EMAPTHSD17B10

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 BRD4 706/4885ALDH1A1 1904/4885KDM4E 2284/4885

“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.