SCHEMBL26035155

SCHEMBL26035155

C=C(C)C(=O)OCCCCCCCCn1ccc(=S)[nH]c1=S

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
HTT P42858 1/20 0.44
MMP2 P08253 2/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CYP2C9 P11712 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
CNR2 P34972 1/20 0.34
THRB P10828 1/20 0.33
MMP9 P14780 1/20 0.33
MMP12 P39900 1/20 0.33
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 3/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL26035157 1.00 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205050 1.00 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205341 1.00 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205051 1.00 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205326 0.95 POLB (0.40) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205337 0.90 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL26035139 0.90 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205324 0.90 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205339 0.90 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL26035144 0.90 TSHR (0.44) TSHRTDP1POLBAPEX1HTT

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-20230273455-A1 OPTICALLY ACTIVE DEVICES JOHNSON & JOHNSON SURGICAL VISION INC (US) 2023-08-31 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-20230273455-A1 OPTICALLY ACTIVE DEVICES PDE6C, PDE6A, PDE6D TSHR 4592/4885TDP1 2946/4885POLB 1376/4885

“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.