SCHEMBL4123552

SCHEMBL4123552

CC(C)(C)OC(=O)Nc1ccc(Cl)cc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.51
HSP90AB1 P08238 2/20 0.51
CXCR2 P25025 2/20 0.48
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
GAA P10253 1/20 0.41
ATR Q13535 1/20 0.41
IDO1 P14902 2/20 0.41
WDR5 P61964 1/20 0.40
KCNQ4 P56696 1/20 0.40
KCNQ5 Q9NR82 1/20 0.40
KCNMA1 Q12791 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 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
SCHEMBL31122314 1.00 HSP90AA1 (0.51) HSP90AA1HSP90AB1CXCR2MEN1KMT2A
SCHEMBL31458629 0.88 KCNMA1 (0.54) HSP90AA1HSP90AB1MEN1KMT2AGAA
SCHEMBL3327166 0.88 KCNMA1 (0.54) HSP90AA1HSP90AB1MEN1KMT2AGAA
SCHEMBL3787046 0.87 KMT2A (0.54) HSP90AA1HSP90AB1MEN1KMT2APDK1
SCHEMBL6628806 0.86 PDK1 (0.56) HSP90AA1HSP90AB1MEN1KMT2APDK1
SCHEMBL5731619 0.84 POLB (0.54) HSP90AA1HSP90AB1MEN1KMT2AGAA
SCHEMBL2391319 0.84 CXCR2 (0.53) CXCR2MEN1KMT2AGAANPC1
SCHEMBL23954504 0.83 KMT2A (0.47) HSP90AA1HSP90AB1MEN1KMT2APDK1
SCHEMBL551648 0.83 HDAC1 (0.50) HSP90AA1HSP90AB1MEN1KMT2APDK1
SCHEMBL12225275 0.83 HSP90AA1 (0.45) HSP90AA1HSP90AB1MEN1KMT2APDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 EP 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR HSP90AA1 4018/4885HSP90AB1 3883/4885CXCR2 1885/4885

“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.