SCHEMBL5956469

SCHEMBL5956469

COC(=O)c1cc2c(cc1OC)C(N)CCS2

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
KDM4E B2RXH2 6/20 0.40
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.35
ALDH1A1 P00352 5/20 0.35
HSD17B10 Q99714 3/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5956457 1.00 GAA (0.43) GAAKDM4EKMT2AMEN1POLB
SCHEMBL5956638 0.85 GAA (0.40) GAAKDM4EKMT2AMEN1POLB
SCHEMBL5956730 0.85 MEN1 (0.41) GAAKDM4EKMT2AMEN1ALDH1A1
SCHEMBL5956504 0.85 MEN1 (0.41) GAAKDM4EKMT2AMEN1ALDH1A1
SCHEMBL5956605 0.85 GAA (0.40) GAAKDM4EKMT2AMEN1POLB
SCHEMBL5956628 0.84 KMT2A (0.38) GAAKDM4EKMT2AMEN1POLB
SCHEMBL5956889 0.84 KMT2A (0.38) GAAKDM4EKMT2AMEN1POLB
SCHEMBL4440145 0.80 KCNMA1 (0.50) KDM4EKMT2AMEN1POLBHTT
SCHEMBL4452193 0.80 KCNMA1 (0.50) KDM4EKMT2AMEN1POLBHTT
SCHEMBL4445247 0.80 KCNMA1 (0.50) KDM4EKMT2AMEN1POLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270570-B1 AMIDE COMPOUNDS AND USE THEREOF MITSUBISHI PHARMA CORP (JP) 2006-05-31 EP disclosed
US-6933305-B2 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-08-23 US disclosed
US-20030158413-A1 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-08-21 US disclosed
EP-1270570-A1 AMIDE COMPOUNDS AND USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-01-02 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-20030158413-A1 Amide compounds and use thereof ROCK2, ROCK1, RHOT2 GAA 1515/4885KDM4E 1686/4885KMT2A 1253/4885

“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.