SCHEMBL6869573

SCHEMBL6869573

Cc1c(OC2CCCCO2)ccc2c(CC(C)COC(=O)OCC(C)Cc3cc(=O)oc4c(C)c(OC5CCCCO5)ccc34)cc(=O)oc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
MEN1 O00255 3/20 0.45
KDM4E B2RXH2 4/20 0.45
HPGD P15428 4/20 0.45
ALDH1A1 P00352 3/20 0.45
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
LMNA P02545 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RCE1 Q9Y256 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL7793594 0.85 KMT2A (0.49) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL6867070 0.79 MAOB (0.51) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL6869569 0.78 MAOA (0.43) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL7793591 0.76 MAOA (0.47) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL6869570 0.76 MAOA (0.43) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL6867087 0.73 RAB9A (0.39) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL6867371 0.73 ALDH1A1 (0.56) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL7794175 0.71 GBA1 (0.42) KMT2AKDM4EHPGDALDH1A1MAOA
SCHEMBL6864371 0.70 NPC1 (0.45) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL6867776 0.69 GBA1 (0.44) KMT2AMEN1KDM4EHPGDALDH1A1

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-6812331-B2 BACTERICIDES AVENTIS PHARMA S.A. (FR) 2004-11-02 US disclosed
US-6350733-B1 4-HYDROXYBENZOPYRAN-2-ONE DERIVATIVES; BACTERICIDES FOR STAPHYLOCOCCUS INFECTIONS; SKIN DISORDERS AVENTIS PHARMA S.A. (FR) 2002-02-26 US disclosed
US-20020010322-A1 New aromatic derivatives substituted by a ribose, their preparation process and their use as medicaments AVENTIS PHARMA S.A. 2002-01-24 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-20020010322-A1 New aromatic derivatives substituted by a ribose, their preparation process and their use as medicaments RPIA, CD38, PARP1 KMT2A 1234/4885MEN1 3924/4885KDM4E 1566/4885

“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.