SCHEMBL18378474

SCHEMBL18378474

CCCCc1ccccc1C([O])CC

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 9/20 0.47
CYSLTR1 Q9Y271 9/20 0.47
LIPG Q9Y5X9 1/20 0.41
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
TLR8 Q9NR97 1/20 0.36
CTRC Q99895 1/20 0.35

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
SCHEMBL18243458 0.89 ADRA2A (0.40) CYSLTR2CYSLTR1
SCHEMBL18243396 0.87 CYSLTR2 (0.49) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL10513059 0.83 CYSLTR2 (0.48) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL18242473 0.82 GABRA1 (0.44) CYSLTR2CYSLTR1CYP3A4CYP2D6
SCHEMBL18241952 0.80 CYSLTR2 (0.46) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL18241880 0.79 CYSLTR2 (0.40) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL10979504 0.79 TSHR (0.52) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL5665256 0.79 CYSLTR2 (0.46) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL9621646 0.79 CYSLTR2 (0.46) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL30436245 0.79 CYSLTR2 (0.46) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6

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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 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 (2 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 CYSLTR2 1119/4885CYSLTR1 1090/4885LIPG 3948/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 CYSLTR2 1119/4885CYSLTR1 1090/4885LIPG 3948/4885

“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.