SCHEMBL6498760

SCHEMBL6498760

COc1ccc(OC)c2c1C(=O)c1c-2n(CCN(C)C)c2ccc(O)cc12

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 10/20 0.48
CHEK1 O14757 7/20 0.44
SRC P12931 2/20 0.44
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41
PIK3CG P48736 1/20 0.41
TDP1 Q9NUW8 5/20 0.40
ESR1 P03372 4/20 0.39
ESR2 Q92731 2/20 0.39
KDR P35968 1/20 0.38

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
SCHEMBL6495062 0.86 WEE1 (0.50) WEE1CHEK1SRCPIK3CAMTOR
SCHEMBL6202615 0.84 WEE1 (0.47) WEE1CHEK1SRCPIK3CAMTOR
SCHEMBL6504952 0.82 WEE1 (0.41) WEE1TDP1
SCHEMBL6505681 0.68 NTRK1 (0.43) WEE1CHEK1TDP1
SCHEMBL6498347 0.68 TDP1 (0.61) WEE1CHEK1SRCPIK3CAMTOR
SCHEMBL6504264 0.67 PTGDR2 (0.41) WEE1CHEK1TDP1
SCHEMBL6503691 0.67 TDP1 (0.40) WEE1CHEK1TDP1
SCHEMBL6505751 0.67 PTGDR2 (0.41) WEE1CHEK1TDP1
SCHEMBL6505761 0.67 PTGDR2 (0.41) WEE1CHEK1TDP1
SCHEMBL6505755 0.66 TDP1 (0.40) WEE1CHEK1TDP1ESR1KDR

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-6844445-B2 Indenoindolone compounds LES LABORATOIRES SERVIER (FR) 2005-01-18 US disclosed
US-20020173531-A1 Indenoindolone compounds LES LABORATOIRES SERVIER (FR) 2002-11-21 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-20020173531-A1 Indenoindolone compounds MTNR1A, MTNR1B, CYP11B1 WEE1 3618/4885CHEK1 4552/4885SRC 4730/4885

“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.