SCHEMBL26035299

SCHEMBL26035299

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

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TK2 O00142 10/20 0.53
CYP2C9 P11712 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 1/20 0.52
TK1 P04183 1/20 0.51
CYP1A2 P05177 3/20 0.48
CYP2C19 P33261 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
GAA P10253 1/20 0.48
MEN1 O00255 1/20 0.48
TYMP P19971 1/20 0.47
TSHR P16473 2/20 0.46
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL26034607 1.00 TK2 (0.53) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL26034665 1.00 TK2 (0.53) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL17583355 0.99 TK1 (0.52) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL17583278 0.90 TYMP (0.54) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL24205258 0.89 TSHR (0.43) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL24205107 0.89 TSHR (0.43) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL26035313 0.88 CYP2C9 (0.44) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL24205123 0.86 LMNA (0.52) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL26034608 0.86 LMNA (0.52) TK2CYP2C9KMT2AMAPTTK1
SCHEMBL24205269 0.85 CYP2C9 (0.50) TK2CYP2C9KMT2AMAPTTK1

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 TK2 3617/4885CYP2C9 1630/4885KMT2A 4011/4885

“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.