SCHEMBL26034700

SCHEMBL26034700

C=C(C)C(=O)OCn1ccc(=O)n(CC)c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD17B13 Q7Z5P4 2/20 0.35
▸ THRB P10828 1/20 0.34
▸ TSHR P16473 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ POLB P06746 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ KMT2A Q03164 2/20 0.31
▸ ATM Q13315 1/20 0.31
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ GRIK3 Q13003 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ MEN1 O00255 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
SCHEMBL26034705 0.89 THRB (0.34) HSD17B13THRBTSHRALDH1A1POLB
SCHEMBL24205096 0.82 TSHR (0.47) HSD17B13THRBTSHRPOLBAPEX1
SCHEMBL26034446 0.82 TSHR (0.47) HSD17B13THRBTSHRPOLBAPEX1
SCHEMBL26034717 0.81 LPO (0.40) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL26034769 0.78 LPO (0.35) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL25368674 0.77 TSHR (0.47) THRBTSHRPOLBAPEX1HTT
SCHEMBL26034448 0.75 TSHR (0.45) THRBTSHRPOLBAPEX1HTT
SCHEMBL24205106 0.74 TSHR (0.46) THRBTSHRPOLBAPEX1HTT
SCHEMBL831448 0.73 TSHR (0.47) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL24205329 0.73 TSHR (0.55) THRBTSHRALDH1A1POLBAPEX1

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 HSD17B13 3929/4885THRB 4667/4885TSHR 4592/4885

“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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