SCHEMBL6464526

SCHEMBL6464526

COc1cccc(C(c2ccccc2)(c2ccccc2)C(O)CCNC(=O)C(F)(F)F)c1OC

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.39
GAA P10253 1/20 0.39
CNR1 P21554 3/20 0.39
CNR2 P34972 3/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
MTNR1A P48039 2/20 0.37
MTNR1B P49286 2/20 0.37
HTT P42858 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36

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
SCHEMBL6465472 0.88 HPGD (0.38) HPGDGAACNR1CNR2KDM4E
SCHEMBL17825593 0.81 KDM4E (0.38) HPGDGAACNR1CNR2KDM4E
SCHEMBL9068005 0.79 L3MBTL1 (0.37) KDM4EKMT2AATMSMN1; SMN2HTT
SCHEMBL9261650 0.79 TAS1R3 (0.36) CNR1CNR2KMT2ASMN1; SMN2HTT
SCHEMBL8842917 0.77 HPGD (0.39) HPGDGAAKDM4EPOLBKMT2A
SCHEMBL8843149 0.77 KMT2A (0.40) HPGDGAAKDM4EPOLBKMT2A
SCHEMBL8843206 0.77 HPGD (0.39) HPGDGAAKDM4EPOLBKMT2A
SCHEMBL8734436 0.75 SMN1; SMN2 (0.35) CNR1CNR2KDM4EKMT2ASMN1; SMN2
SCHEMBL5023010 0.74 CHRM2 (0.36) CNR1CNR2SMN1; SMN2TAAR1
SCHEMBL8457737 0.74 KMT2A (0.42) GAAKDM4EKMT2AATM

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-20050009041-A1 Peptide nucleic acids and synthetic procedures therefor BUCHARDT OLE (DK) 2005-01-13 US disclosed
US-6713602-B1 COMPOUNDS THAT ARE NOT POLYNUCLEOTIDES YET WHICH BIND TO COMPLEMENTARY DNA AND RNA STRANDS MORE STRONGLY THE CORRESPONDING DNA BUCHARDT OLE (DK) 2004-03-30 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-20050009041-A1 Peptide nucleic acids and synthetic procedures therefor POLRMT, CPSF7, RNGTT HPGD 4345/4885GAA 1440/4885CNR1 4862/4885

“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.