SCHEMBL26530635

SCHEMBL26530635

COC(CO)CSSc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MGLL Q99685 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
KIF11 P52732 2/20 0.33
MMP12 P39900 1/20 0.32
MTNR1A P48039 3/20 0.32
MTNR1B P49286 3/20 0.32
TRPA1 O75762 3/20 0.31
AGTR1 P30556 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 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
SCHEMBL20753263 0.74 MAPT (0.42) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL10066790 0.72 TOP2A (0.44) TSHRMAPTSMN1; SMN2LMNA
SCHEMBL10066795 0.72 CYP2C9 (0.32) CYP2C9TSHR
SCHEMBL576229 0.71 SMN1; SMN2 (0.48) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL5704664 0.68 TRPA1 (0.53) CYP2C9TSHRHSD17B10MAOATRPA1
SCHEMBL29201828 0.68 HPGD (0.55) CYP2C9TSHRMAPTHPGDSMN1; SMN2
SCHEMBL18271751 0.68 KMT2A (0.41) CYP2C9HSD17B10MTNR1AMTNR1BLMNA
SCHEMBL10066794 0.67 CYP2C9 (0.37) CYP2C9TSHR
SCHEMBL6069095 0.67 MTNR1A (0.46) CYP2C9TSHRSMN1; SMN2MTNR1AMTNR1B
SCHEMBL6069094 0.67 MTNR1A (0.46) CYP2C9TSHRSMN1; SMN2MTNR1AMTNR1B

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-20230322742-A1 ORTHOESTER COMPOSITIONS FOR AFFINITY PURIFICATION OF OLIGONUCLEOTIDES AGILENT TECHNOLOGIES, 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-20230322742-A1 ORTHOESTER COMPOSITIONS FOR AFFINITY PURIFICATION OF OLIGONUCLEOTIDES RNGTT, OSBPL8, DCLRE1B CYP2C9 2673/4885TSHR 428/4885MAPT 1562/4885

“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.