SCHEMBL7675486

SCHEMBL7675486

O=C1Cc2c(cc(C(=O)c3ccc(Cl)cc3)n2Cc2ccccc2)O1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
TP53 P04637 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
FNTA P49354 2/20 0.40
FNTB P49356 2/20 0.40
CNR2 P34972 2/20 0.40
CCR2 P41597 1/20 0.39
ADORA1 P30542 1/20 0.39
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NR4A1 P22736 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.37
CA9 Q16790 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
SCHEMBL7678501 0.93 TSHR (0.39) MAPTTP53SMN1; SMN2RXFP1CNR2
SCHEMBL7681025 0.90 ALDH1A1 (0.41) MAPTTP53FNTAFNTBALDH1A1
SCHEMBL7678040 0.86 SLC6A12 (0.41) MAPTTP53SMN1; SMN2RXFP1ALDH1A1
SCHEMBL7677949 0.86 ALDH1A1 (0.41) MAPTTP53SMN1; SMN2ALDH1A1LMNA
SCHEMBL7674512 0.85 MAPK1 (0.46) MAPTSMN1; SMN2CNR2ALDH1A1L3MBTL1
SCHEMBL7676770 0.85 MAPT (0.40) MAPTTP53FNTAFNTBALDH1A1
SCHEMBL7682148 0.80 MAOA (0.39) MAPTTP53FNTAFNTBALDH1A1
SCHEMBL7676913 0.78 HTT (0.46) MAPTTP53SMN1; SMN2FNTAFNTB
SCHEMBL7678575 0.76 MAPT (0.41) MAPTTP53SMN1; SMN2RXFP1FNTA
SCHEMBL7678702 0.73 MAOA (0.41) MAPTSMN1; SMN2ALDH1A1L3MBTL1LMNA

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 4/4885SMN1; SMN2 2392/4885

“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.