SCHEMBL7678575

SCHEMBL7678575

CC1C(=O)Oc2cc(C(=O)c3ccc(Cl)cc3)n(Cc3ccccc3)c21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.41
CNR2 P34972 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
CCR2 P41597 1/20 0.38
SMO Q99835 2/20 0.37
ALDH1A1 P00352 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
NR4A1 P22736 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL7676766 0.87 ALDH1A1 (0.41) MAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL7675561 0.87 MAPK1 (0.43) MAPTTP53CNR2SMN1; SMN2ALDH1A1
SCHEMBL7674662 0.86 HTT (0.39) MAPTTP53SMN1; SMN2FNTAFNTB
SCHEMBL7678489 0.84 HTT (0.46) MAPTSMN1; SMN2FNTAFNTBALDH1A1
SCHEMBL7675515 0.82 ALDH1A1 (0.35) MAPTSMN1; SMN2FNTAFNTBALDH1A1
SCHEMBL7682039 0.78 MEN1 (0.37) MAPTTP53CNR2CCR2
SCHEMBL7678105 0.78 TDP1 (0.38) MAPTFNTAFNTBALDH1A1
SCHEMBL7675486 0.76 MAPT (0.45) MAPTTP53CNR2SMN1; SMN2RXFP1
SCHEMBL7675675 0.75 HTT (0.42) MAPTSMN1; SMN2FNTAFNTBALDH1A1
SCHEMBL7678067 0.73 CXCL8 (0.41) MAPTSMN1; SMN2ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6455703-B2 ADMINISTERING EFFECTIVE AMOUNT OF 1,3,6-TRIHYDRO-6-AZA-3-OXAPENTALEN-2-ONE DERIVATIVE TO THE PATIENT FOR INDUCING OR PROMOTING APOPTOSIS AND FOR ARRESTING UNCONTROLLED NEOPLASTIC CELL PROLIFERATION CELL PATHWAYS, INC. 2002-09-24 US disclosed
US-20010051651-A1 1,3,6,-trihydro-6-aza-3-oxapentalen-2-one derivatives for the treatment of neoplasia OSI PHARMACEUTICALS, INC. 2001-12-13 US disclosed
US-6160003-A 1,3,6-trihydro-6-aza-3-oxapentalen-2-one derivatives for the treatment of neoplasia CELL PATHWAYS, INC. (US) 2000-12-12 US disclosed
US-5939417-A 1,3,6-trihydro-6-aza-3-oxapentalen-2-one derivatives for the treatment of neoplasia CELL PATHWAYS INC (US) 1999-08-17 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-20010051651-A1 1,3,6,-trihydro-6-aza-3-oxapentalen-2-one derivatives for the treatment of neoplasia MALT1, VHL, CDKN1A MAPT 4570/4885TP53 4/4885CNR2 4197/4885

“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.