SCHEMBL6660033

SCHEMBL6660033

CC(C)(C)OC(=O)NCC(=O)OCCN1CCN(c2cccc3c2C(=O)c2ccccc2C3=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
NPSR1 Q6W5P4 2/20 0.56
DRD2 P14416 13/20 0.50
EGFR P00533 2/20 0.50
MAPK1 P28482 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
DRD3 P35462 6/20 0.47
ALDH1A1 P00352 1/20 0.45
RAF1 P04049 1/20 0.45
ALOX12 P18054 1/20 0.45
MAP2K1 Q02750 1/20 0.45
DRD4 P21917 5/20 0.44
SIGMAR1 Q99720 1/20 0.44
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ADRA1D P25100 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
SCHEMBL7759715 0.82 MAPT (0.65) MAPTNPSR1DRD2EGFRMAPK1
Trifluoroacetic Acid SCHEMBL6661975 0.78 MAPT (0.57) MAPTNPSR1DRD2EGFRMAPK1
SCHEMBL6660597 0.76 MALT1 (0.51) MAPTNPSR1EGFRMAPK1KMT2A
SCHEMBL6663398 0.75 EGFR (0.48) MAPTNPSR1EGFRMAPK1KMT2A
SCHEMBL6663857 0.74 EGFR (0.47) MAPTNPSR1EGFRMAPK1KMT2A
SCHEMBL7060304 0.73 DRD2 (0.48) MAPTNPSR1DRD2EGFRMAPK1
SCHEMBL6661677 0.73 MAPT (1.00) MAPTNPSR1DRD2EGFRMAPK1
SCHEMBL13519655 0.73 SIGMAR1 (0.42) DRD2KMT2ALMNAALDH1A1SIGMAR1
SCHEMBL6666935 0.72 MAPT (0.45) MAPTNPSR1EGFRMAPK1KMT2A
SCHEMBL6659654 0.70 MAPT (0.46) MAPTNPSR1DRD2EGFRMAPK1

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
EP-1087935-B1 ANTHRACENE DERIVATIVES AS ANTI-CANCER AGENTS BTG INT LTD (GB) 2004-08-18 EP disclosed
US-20030203975-A1 Anti-cancer agents BTG INTERNATIONAL LIMITED (GB) 2003-10-30 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-20030203975-A1 Anti-cancer agents TOP2B, TOP2A, TOP1 MAPT 4879/4885NPSR1 2757/4885DRD2 4407/4885

“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.