SCHEMBL6101735

SCHEMBL6101735

O=C1c2c(c(O)c3nccnc3c2O)C(=O)N1Cc1cccc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
KDM4E B2RXH2 2/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 6/20 0.54
MEN1 O00255 3/20 0.54
HPGD P15428 1/20 0.54
ATM Q13315 1/20 0.46
EGLN1 Q9GZT9 1/20 0.45
CASP6 P55212 1/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
TYR P14679 1/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
CYP1A2 P05177 1/20 0.41
GAA P10253 1/20 0.41
GRIN1 Q05586 1/20 0.40
GRIN2B Q13224 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
SCHEMBL5768645 0.93 MAPT (0.49) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL6101670 0.90 KDM4E (0.42) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL5766292 0.85 CA12 (0.41) KDM4EKMT2AMEN1EGLN1CYP2C19
SCHEMBL5767865 0.84 KCNN4 (0.46) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL5795396 0.84 KDM4E (0.38) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL6098180 0.84 UBE2N (0.45) MAPTKMT2AMEN1CYP2C19SMN1; SMN2
SCHEMBL5767355 0.84 KDM4E (0.43) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL5767183 0.83 KMT2A (0.46) MAPTKMT2AMEN1CYP1A2GAA
SCHEMBL6101386 0.82 KMT2A (0.43) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL6102479 0.82 PARP1 (0.41) MAPTKDM4EMAPK1KMT2AMEN1

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-20060211724-A1 Hiv integrase inhibitors VERSCHUEREN GASTON W 2006-09-21 US claimed
US-20060211724-A1 Hiv integrase inhibitors VERSCHUEREN GASTON W 2006-09-21 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-20060211724-A1 Hiv integrase inhibitors SULT1A1, SULT2A1, SULT1E1 MAPT 4622/4885KDM4E 4133/4885MAPK1 1746/4885

“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.