SCHEMBL6566646

SCHEMBL6566646

COC(=O)c1cc(NC(=O)Nc2ccc(/C=C/c3ccc(OC)cc3)cc2)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.52
RAB9A P51151 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
NPC1 O15118 5/20 0.50
MAPT P10636 5/20 0.50
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
LMNA P02545 2/20 0.48
EGFR P00533 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
CASR P41180 1/20 0.46
HDAC1 Q13547 1/20 0.45
HIF1A Q16665 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 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
SCHEMBL6566652 1.00 SNCA (0.52) SNCARAB9ASMN1; SMN2NPC1MAPT
SCHEMBL6568011 0.95 KDM4E (0.54) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL6567596 0.94 MEN1 (0.52) SNCARAB9ASMN1; SMN2NPC1MAPT
SCHEMBL6567591 0.94 MEN1 (0.52) SNCARAB9ASMN1; SMN2NPC1MAPT
SCHEMBL6568152 0.89 RAB9A (0.48) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL6564786 0.88 KMT2A (0.61) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL6566525 0.87 SMN1; SMN2 (0.52) SMN1; SMN2KDM4EMEN1KMT2ALMNA
SCHEMBL6567928 0.87 MEN1 (0.49) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL6565806 0.87 TP53 (0.52) RAB9ASMN1; SMN2NPC1MAPTKDM4E
SCHEMBL6564574 0.86 TSHR (0.55) RAB9ASMN1; SMN2NPC1MAPTKDM4E

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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 SNCA 1789/4885RAB9A 1322/4885SMN1; SMN2 2126/4885

“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.