SCHEMBL26501709

SCHEMBL26501709

Cc1ccc(CS(=O)(=O)Cc2ccc(C(C)C)cc2)nn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
KMT2A Q03164 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
CNR2 P34972 2/20 0.35
ALDH1A1 P00352 4/20 0.34
IDO1 P14902 2/20 0.33
GRM4 Q14833 1/20 0.33
DRD3 P35462 2/20 0.32
KCNH2 Q12809 2/20 0.32
DRD2 P14416 1/20 0.32
CNR1 P21554 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
PKM P14618 1/20 0.32
DHFR P00374 1/20 0.32
COPS5 Q92905 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
PANK3 Q9H999 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
SCHEMBL26501712 0.87 KMT2A (0.31) KMT2AALDH1A1
SCHEMBL26501713 0.87 ALDH1A1 (0.33) KMT2AALDH1A1
SCHEMBL26501716 0.86 ABCB11 (0.32) KMT2APANK3POLB
SCHEMBL26501715 0.86 TAAR1 (0.36)
SCHEMBL26501714 0.85 PANK3 (0.36) PANK3
SCHEMBL26501718 0.81 PANK3 (0.35) KMT2ALMNAMEN1PANK3
SCHEMBL26501733 0.81 ALDH1A1 (0.40) BCHEACHEKMT2ALMNAMEN1
SCHEMBL26501711 0.79 ALDH1A1 (0.38) BCHEACHEKMT2ALMNAMEN1
SCHEMBL26501719 0.77 KDM4E (0.33) ALDH1A1GAA
SCHEMBL26501648 0.76 DHFR (0.47) BCHEACHEKMT2ALMNAMEN1

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 BCHE 985/4885ACHE 4173/4885KMT2A 1296/4885

“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.