SCHEMBL3207183

SCHEMBL3207183

Cc1c(CO)sc2c(-c3cc(C(=O)O)ccn3)cccc12.Cc1c(CO)sc2c(B3OC(C)(C)C(C)(C)O3)cccc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 11/20 0.38
KDM5B Q9UGL1 6/20 0.34
KDM4A O75164 5/20 0.34
KDM5C P41229 4/20 0.34
KDM4B O94953 2/20 0.34
KDM5A P29375 4/20 0.33
KDM2B Q8NHM5 1/20 0.33
KDM3A Q9Y4C1 4/20 0.33
KDM6B O15054 3/20 0.33
KDM2A Q9Y2K7 3/20 0.33
KDM4E B2RXH2 2/20 0.33
PFKFB4 Q16877 2/20 0.33
ROCK1 Q13464 1/20 0.33
HDAC1 Q13547 1/20 0.32
KDM4D Q6B0I6 2/20 0.32
PDE10A Q9Y233 1/20 0.31
TBXAS1 P24557 2/20 0.31
HIF1AN Q9NWT6 1/20 0.31

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
SCHEMBL3207187 0.90 JMJD6 (0.33) HDAC1
SCHEMBL3206270 0.81 KDM4C (0.40) KDM4CKDM5BKDM4AKDM5CKDM4B
SCHEMBL3215570 0.79 KDM4C (0.40) KDM4CKDM5BKDM4AKDM5CKDM4B
SCHEMBL1851302 0.77 KDM4E (0.46) KDM4CKDM5BKDM5CKDM3AKDM6B
SCHEMBL3212096 0.74 JAK2 (0.32)
SCHEMBL3206278 0.71 ALDH1A1 (0.35)
SCHEMBL1856110 0.71 KDM4C (0.51) KDM4CROCK1
SCHEMBL3215577 0.68 ALDH1A1 (0.37) PFKFB4ROCK1
SCHEMBL1853064 0.68 KDM4C (0.48) KDM4CROCK1
SCHEMBL3198407 0.68 KDM4E (0.45) KDM4CKDM5BKDM5CKDM3AKDM6B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 KDM4C 2640/4885KDM5B 2095/4885KDM4A 1985/4885

“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.