SCHEMBL24205258

SCHEMBL24205258

C=C(C)C(=O)OCCCCCCn1cc(C)c(=O)[nH]c1=S

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
TK2 O00142 10/20 0.42
TK1 P04183 1/20 0.41
CYP2C9 P11712 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CYP1A2 P05177 3/20 0.38
CYP2C19 P33261 3/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
TYMP P19971 1/20 0.37

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
SCHEMBL24205107 1.00 TSHR (0.43) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL24205256 0.89 TSHR (0.43) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL26034665 0.89 TK2 (0.53) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL26034607 0.89 TK2 (0.53) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL26035299 0.89 TK2 (0.53) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL17583355 0.88 TK1 (0.52) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL1652710 0.86 CYP2C9 (0.47) TSHRTK2CYP2C9KMT2AMAPT
SCHEMBL26035313 0.85 CYP2C9 (0.44) TSHRTK2TK1CYP2C9KMT2A
SCHEMBL26035312 0.84 TSHR (0.39) TSHRTK2CYP2C9KMT2AMAPT
SCHEMBL26035287 0.84 TSHR (0.44) TSHRTK2TK1CYP2C9KMT2A

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 2 patents. 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
WO-2022012798-A1 OPTICALLY ACTIVE DEVICES MERCK PATENT GMBH (DE) 2022-01-20 WO 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 4592/4885TK2 3617/4885TK1 2438/4885

“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.