SCHEMBL1851004

SCHEMBL1851004

COC(=O)c1ccnc(-c2cccc3sc(CBr)cc23)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
KDM4C Q9H3R0 2/20 0.48
KDM6B O15054 1/20 0.48
KDM5C P41229 1/20 0.48
KDM2A Q9Y2K7 1/20 0.48
KDM3A Q9Y4C1 1/20 0.48
JMJD6 Q6NYC1 1/20 0.44
KDM5B Q9UGL1 1/20 0.43
ROCK1 Q13464 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 3/20 0.41
HPGD P15428 2/20 0.41
NPC1 O15118 2/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL1850714 0.90 KDM4E (0.49) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1851474 0.83 KDM4E (0.47) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1855326 0.81 KDM4E (0.44) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1852186 0.80 GPR52 (0.56) KDM4CROCK1
SCHEMBL3198407 0.78 KDM4E (0.45) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1850872 0.75 KDM4C (0.49) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1856131 0.74 KDM4E (0.42) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1853424 0.73 KDM4E (0.48) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1851273 0.73 TP53 (0.46) SMN1; SMN2RAB9AHPGDNPC1TP53
SCHEMBL1857757 0.72 GPR52 (0.57)

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
EP-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 KDM4E 3467/4885KDM4C 2640/4885KDM6B 3232/4885

“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.