SCHEMBL26501668

SCHEMBL26501668

Cc1ccc(CC(=O)Cc2ccc(C(F)F)cc2)nn1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.33
HTT P42858 1/20 0.33
PDE2A O00408 4/20 0.32
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
F2 P00734 1/20 0.30

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
SCHEMBL26501518 0.87 CNR2 (0.38) CNR2
SCHEMBL26501671 0.86 CNR2 (0.33) GLSHTTTDP1L3MBTL1CNR2
SCHEMBL26501672 0.84 PANK3 (0.43) GLSHTTPDE2ATDP1L3MBTL1
SCHEMBL26501676 0.83 PANK3 (0.39) GLSHTTTDP1L3MBTL1KEAP1
SCHEMBL26501674 0.82 TAAR1 (0.36) GLSHTTKEAP1NFE2L2F2
SCHEMBL26501785 0.81 RAB9A (0.36) HTTPDE2ATDP1L3MBTL1
SCHEMBL26501667 0.78 NR1H4 (0.40)
SCHEMBL26501695 0.78 SMN1; SMN2 (0.40) TDP1
SCHEMBL26501651 0.77 DHFR (0.34)
SCHEMBL26501559 0.77 RAB9A (0.35) TDP1L3MBTL1

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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 GLS 57/4885HTT 2621/4885PDE2A 1759/4885

“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.