SCHEMBL1712285

SCHEMBL1712285

Fc1ccc(OCc2cc[c]cc2)nc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.47
GRM5 P41594 10/20 0.41
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
ELOVL1 Q9BW60 1/20 0.35
GABRA5 P31644 1/20 0.35
MAOB P27338 2/20 0.35
APP P05067 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
SCHEMBL28791339 0.82 CXCR2 (0.63) CXCR2GRM5GABRA5
SCHEMBL1712453 0.79 KDM4E (0.36) MAOB
SCHEMBL509327 0.79 MAOB (0.46) CXCR2GRM5CYP11B1CYP11B2GABRA5
SCHEMBL16093377 0.77 CXCR2 (0.45) CXCR2GRM5CYP11B1CYP11B2ELOVL1
SCHEMBL1711618 0.76 MAOB (0.42) MAOBAPP
SCHEMBL510483 0.76 ALDH1A1 (0.55) CXCR2GRM5CYP11B1CYP11B2MAOB
SCHEMBL1712062 0.75 GRM5 (0.41) GRM5ELOVL1GABRA5
SCHEMBL16093387 0.73 CXCR2 (0.43) CXCR2GRM5CYP11B1CYP11B2ELOVL1
Methane SCHEMBL9237648 0.72 CXCR2 (0.44) CXCR2ELOVL1MAOBAPP
SCHEMBL510047 0.72 MAOB (0.49) CXCR2ELOVL1GABRA5MAOBAPP

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-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP 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-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 CXCR2 3008/4885GRM5 1690/4885CYP11B1 341/4885

“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.