SCHEMBL6154879

SCHEMBL6154879

Cc1cc(C(N)=O)ccc1NC1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.47
ATAD2 Q6PL18 2/20 0.47
TOP2A P11388 5/20 0.47
HSP90AB1 P08238 3/20 0.47
MAPK14 Q16539 6/20 0.46
MEN1 O00255 1/20 0.42
CYP2D6 P10635 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
KDM1A O60341 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALOX15 P16050 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.40

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
SCHEMBL6156066 0.84 TOP2A (0.43) BRD4ATAD2TOP2AHSP90AB1MAPK14
SCHEMBL6153952 0.84 DDR1 (0.53) TOP2AHSP90AB1ALOX15
SCHEMBL6155256 0.83 TOP2A (0.42) BRD4ATAD2TOP2AHSP90AB1MAPK14
SCHEMBL6154506 0.83 ROCK2 (0.47) BRD4ATAD2TOP2AHSP90AB1MAPK14
SCHEMBL6154711 0.83 TOP2A (0.47) BRD4ATAD2TOP2AHSP90AB1MAPK14
SCHEMBL19245321 0.82 ALOX15 (0.60) BRD4ATAD2MEN1KMT2AALDH1A1
SCHEMBL6153347 0.80 PTK2 (0.41) TOP2AHSP90AB1MAPK14IRAK4
SCHEMBL6154636 0.79 TOP2A (0.46) TOP2AHSP90AB1
SCHEMBL83376 0.77 BRD4 (0.48) BRD4ATAD2MEN1CYP2D6KMT2A
SCHEMBL4144350 0.76 IRAK4 (0.45) BRD4ATAD2HDAC8KDM1AIRAK4

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 BRD4 865/4885ATAD2 2808/4885TOP2A 4307/4885

“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.