SCHEMBL4420957

SCHEMBL4420957

CC(CCCc1ccc(O)cc1O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYR P14679 6/20 0.57
MEN1 O00255 1/20 0.53
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
ALOX5 P09917 1/20 0.53
MAPT P10636 1/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL70013 0.82 TYR (0.66) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL4984449 0.79 TYR (0.48) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL31745134 0.77 ESR1 (0.47) TP53CYP3A4
SCHEMBL8764373 0.76 TYR (0.63) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL5654220 0.76 TYR (0.67) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL27643967 0.76 TYR (0.47) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL4370686 0.75 TYR (0.81) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL8444198 0.75 TYR (0.65) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL31536236 0.75 TYR (0.65) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10404683 0.74 TYR (0.65) TYRMEN1TP53CYP3A4ALOX5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541454-B2 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2009-06-02 US disclosed
US-20050159606-A1 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2005-07-21 US disclosed
WO-2005040357-A2 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING EPOCH BIOSCIENCES, INC. (US) 2005-05-06 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-20050159606-A1 Compounds and methods for fluorescent labeling TFEB, HLCS, PFAS TYR 1222/4885MEN1 1387/4885TP53 188/4885

“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.