SCHEMBL18652185

SCHEMBL18652185

CC(C)(C)CNC(=O)CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHF8 Q9UPP1 6/20 0.46
KDM2A Q9Y2K7 6/20 0.46
KDM4E B2RXH2 4/20 0.46
KDM5C P41229 4/20 0.46
EGLN1 Q9GZT9 4/20 0.46
KDM6B O15054 2/20 0.46
FOLH1 Q04609 1/20 0.46
KDM7A Q6ZMT4 1/20 0.45
LMNA P02545 2/20 0.41
ALKBH5 Q6P6C2 1/20 0.41
SUCNR1 Q9BXA5 1/20 0.41
HTT P42858 2/20 0.39
SLC15A2 Q16348 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.36
ALDH1A1 P00352 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
FFAR3 O14843 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL4028377 0.83 PHF8 (0.43) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL27665147 0.83 PHF8 (0.46) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL18272882 0.81 ALDH1A1 (0.39) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL21972752 0.81 KMT2A (0.50) ALDH1A1
SCHEMBL30379304 0.81 RECQL (0.32) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL22636510 0.81 RECQL (0.32) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL29403659 0.81 RECQL (0.32) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL22636521 0.81 RECQL (0.32) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL11078958 0.80 ALDH1A1 (0.33) ALDH1A1
SCHEMBL21015969 0.79 CACNA1H (0.39) ALDH1A1

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-20170081346-A1 MESOSCOPIC MATERIALS COMPRISED OF ORDERED SUPERLATTICES OF MICROPOROUS METAL-ORGANIC FRAMEWORKS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-03-23 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-20170081346-A1 MESOSCOPIC MATERIALS COMPRISED OF ORDERED SUPERLATTICES OF MICROPOROUS METAL-ORGANIC FRAMEWORKS MCM2, YTHDF2, MCM6 PHF8 2346/4885KDM2A 388/4885KDM4E 1665/4885

“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.