SCHEMBL5530135

SCHEMBL5530135

CCOC(=O)c1cn(-c2ccc(CN3CC[C@H](O)C3)cc2)c2c(Cl)c(N3CCN(c4ccccn4)CC3)c(F)cc2c1=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
HTT P42858 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 4/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 4/20 0.40
ATM Q13315 1/20 0.40
TOP1 P11387 5/20 0.39
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
STAT3 P40763 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CMA1 P23946 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
SCHEMBL14417318 0.93 KDM4E (0.42) KMT2AHTTMEN1KDM4EHPGD
SCHEMBL5533348 0.91 HTT (0.42) KMT2AHTTMEN1LMNAMAPK1
SCHEMBL5530220 0.91 CYP3A4 (0.44) LMNAKDM4EHPGDALDH1A1TOP1
SCHEMBL5519872 0.89 HTT (0.44) KMT2AHTTMEN1LMNAMAPK1
SCHEMBL5525438 0.88 ALDH1A1 (0.45) KMT2AHTTMEN1LMNAMAPK1
SCHEMBL5525609 0.86 ALDH1A1 (0.41) KMT2AHTTMEN1LMNAMAPK1
SCHEMBL5526204 0.84 STAT3 (0.46) KMT2AHTTKDM4EHPGDCYP2C19
SCHEMBL5530189 0.83 CYP3A4 (0.46) LMNAKDM4EHPGDALDH1A1TOP1
SCHEMBL5528707 0.82 STAT3 (0.46) KMT2AHTTMEN1LMNAMAPK1
SCHEMBL5526755 0.81 HPGD (0.45) HTTKDM4EHPGDALDH1A1TOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213339-A1 Quinolone Carboxylic Acid Derivatives for Treatment of Hyperproliferative Conditions BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-13 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-20070213339-A1 Quinolone Carboxylic Acid Derivatives for Treatment of Hyperproliferative Conditions TP53, RB1, HRAS KMT2A 2389/4885HTT 3021/4885MEN1 1653/4885

“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.