SCHEMBL5113685

SCHEMBL5113685

CC(C)Oc1ccc(C=O)c(OCc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 2/20 0.52
▸ MCL1 Q07820 1/20 0.46
▸ PTPN1 P18031 1/20 0.46
▸ EDNRA P25101 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAOB P27338 2/20 0.44
▸ ERN1 O75460 2/20 0.44
▸ CCNB2 O95067 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ CCNB1 P14635 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ CCNB3 Q8WWL7 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ RECQL P46063 1/20 0.43

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
SCHEMBL2354146 0.89 MAOB (0.50) HDAC8MCL1PTPN1EDNRALMNA
SCHEMBL865350 0.86 MAOA (0.58) HDAC8PTPN1MAOBERN1CCNB2
SCHEMBL3202531 0.85 HDAC8 (0.63) HDAC8LMNAKDM4EALDH1A1PTGDR
SCHEMBL3202547 0.85 HDAC8 (0.63) HDAC8LMNAKDM4EALDH1A1PTGDR
SCHEMBL1311076 0.85 HDAC8 (0.65) HDAC8LMNAMAOBERN1KDM4E
SCHEMBL2555535 0.82 ERN1 (0.49) HDAC8EDNRALMNAL3MBTL1MAOB
SCHEMBL4567002 0.81 MDM2 (0.50) HDAC8PTPN1L3MBTL1MAOBERN1
SCHEMBL1963431 0.81 HDAC8 (0.52) HDAC8PTPN1MAOBERN1CCNB2
SCHEMBL3883024 0.81 TYR (0.46) HDAC8L3MBTL1MAOBERN1CCNB2
SCHEMBL3370062 0.81 MAOB (0.52) HDAC8PTPN1LMNAMAOBERN1

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-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 — — US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 — — 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 HDAC8 156/4885MCL1 4006/4885PTPN1 1152/4885

“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.

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