SCHEMBL25144538

SCHEMBL25144538

CC(=O)OC(CNC(C)C)COC(C)S

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ADRB2 P07550 7/20 0.32
▸ ADRB1 P08588 7/20 0.32
▸ ADRB3 P13945 7/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ TBXA2R P21731 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
SCHEMBL25144614 0.86 TSHR (0.40) TSHRTDP1ADRB2ADRB1ADRB3
SCHEMBL21113533 0.70 TSHR (0.48) TSHRTDP1ADRB2ADRB1ADRB3
SCHEMBL25144825 0.69 ADRB2 (0.34) ADRB2ADRB1ADRB3
SCHEMBL25144721 0.69 ADRB2 (0.34) ADRB2ADRB1ADRB3
SCHEMBL25144643 0.67 ADRB2 (0.31) ADRB2ADRB1ADRB3
SCHEMBL19034592 0.67 ADRB2 (0.37) ADRB2ADRB1ADRB3
SCHEMBL12285560 0.66 TSHR (0.53) TSHRADRB2ADRB1ADRB3
SCHEMBL5913624 0.64 — —
SCHEMBL10285998 0.63 TSHR (0.46) TSHRTDP1MEN1CYP1A2KMT2A
SCHEMBL4808933 0.63 PRKCA (0.47) TSHR

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-20230119227-A1 OLIGONUCLEOTIDE SYNTHESIS ON SOLID SUPPORT INTEGRATED DNA TECHNOLOGIES, INC. 2023-04-20 — — 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-20230119227-A1 OLIGONUCLEOTIDE SYNTHESIS ON SOLID SUPPORT RNGTT, SSU72, NSUN2 TSHR 2212/4885TDP1 569/4885ADRB2 4792/4885

“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.

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