SCHEMBL29596056

SCHEMBL29596056

CCCCCc1cc(O)c(OC)c(O)c1OC

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 13/20 0.56
▸ PTGS2 P35354 5/20 0.51
▸ CNR2 P34972 1/20 0.48
▸ TYR P14679 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ PTGES O14684 1/20 0.41

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
SCHEMBL10602394 0.85 ALOX5 (0.60) ALOX5PTGS2CNR2TYRMEN1
SCHEMBL15944479 0.83 ALOX5 (0.61) ALOX5PTGS2TYRMEN1TP53
SCHEMBL15229247 0.80 PTGS2 (0.55) ALOX5PTGS2TYRMEN1TP53
SCHEMBL27980745 0.80 ALOX5 (0.66) ALOX5PTGS2TYRMEN1TP53
SCHEMBL14347048 0.79 ALOX5 (0.56) ALOX5PTGS2CNR2TYRMEN1
SCHEMBL5031047 0.79 ALOX5 (0.51) ALOX5PTGS2CNR2TYR
SCHEMBL5590550 0.79 PTGES (0.53) ALOX5CNR2PTGES
SCHEMBL5590194 0.77 BID (0.52) ALOX5PTGS2PTGES
SCHEMBL5587994 0.77 BID (0.52) ALOX5PTGS2PTGES
SCHEMBL5586822 0.77 BID (0.52) ALOX5PTGS2PTGES

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-20230100363-A1 MOLECULARLY IMPRINTED POLYMERS FOR EXTRACTION OF CANNABINOIDS AND USES THEREOF ORCA HOLDINGS, LLC 2023-03-30 — — US disclosed
US-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses Leibniz-Institut für Naturstoff-Forschung und Infektionsbiologie e. V. Hans-Knöll-Institut (DE) 2022-11-01 — — US disclosed
US-20220177666-A1 MOLECULARLY IMPRINTED POLYMERS FOR EXTRACTION OF CANNABINOIDS AND USES THEREOF ORCA HOLDINGS, LLC 2022-06-09 — — 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 (3 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-20230100363-A1 MOLECULARLY IMPRINTED POLYMERS FOR EXTRACTION OF CANNABINOIDS AND USES THEREOF CNR2, CNR1, CDIPT ALOX5 2622/4885PTGS2 2919/4885CNR2 1/4885
US-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses CBR3, POR, CYP2F1 ALOX5 193/4885PTGS2 603/4885CNR2 671/4885
US-20220177666-A1 MOLECULARLY IMPRINTED POLYMERS FOR EXTRACTION OF CANNABINOIDS AND USES THEREOF CNR2, CNR1, CDIPT ALOX5 2622/4885PTGS2 2919/4885CNR2 1/4885

“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.

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