SCHEMBL4409587

SCHEMBL4409587

CCCCc1cc[c]cc1OC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.42
PTGS2 P35354 4/20 0.42
PPARA Q07869 1/20 0.38
HTR2A P28223 1/20 0.36
ELANE P08246 1/20 0.36
CTSG P08311 1/20 0.36

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
SCHEMBL5335649 0.95 ALOX5 (0.49) ALOX5PTGS2PPARAHTR2AELANE
SCHEMBL6023397 0.93 ALOX5 (0.47) ALOX5PTGS2PPARAHTR2AELANE
SCHEMBL8475524 0.89 HMGCR (0.43) ALOX5PTGS2ELANE
SCHEMBL8347519 0.84 TAAR1 (0.33) ALOX5PTGS2
SCHEMBL27660862 0.84 CYP1A2 (0.40)
SCHEMBL27980761 0.84 TAAR1 (0.44)
SCHEMBL27660863 0.84 CYP1A2 (0.40)
SCHEMBL27980507 0.83 TAAR1 (0.43)
SCHEMBL456067 0.81 TAAR1 (0.37) PTGS2
SCHEMBL11560689 0.81 ALOX5 (0.49) ALOX5PTGS2PPARAHTR2AELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541332-B2 Fungal cell wall synthesis gene EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-20080261272-A1 FUNGAL CELL WALL SYNTHESIS GENE EISAI R&D MANAGEMENT CO., LTD (JP) 2008-10-23 US disclosed
US-7375204-B2 Fungal cell wall synthesis gene EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-05-20 US disclosed
US-20060234283-A1 Fungal cell wall synthesis gene EISAI CO., LTD. (JP) 2006-10-19 US disclosed
US-20060234349-A1 Fungal cell wall synthesis gene EISAI CO., LTD. (JP) 2006-10-19 US disclosed
EP-1300464-A1 FUNGAL CELL WALL SYNTHESIS GENE Eisai Co., Ltd. (JP) 2003-04-09 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-20060234349-A1 Fungal cell wall synthesis gene ERG28, GPI, DPM1 ALOX5 2868/4885PTGS2 2967/4885PPARA 4804/4885

“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.