SCHEMBL29307791

SCHEMBL29307791

CCCCCOc1cc2c(cc1OCCCCC)c1c3nc(-c4ccccc4)oc3c(OCCCCC)c3c4cc(OC)c(C)cc4c4c(OCCCCC)c(OCCCCC)cc2c4c31

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ KCNA3 P22001 2/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ PDE3B Q13370 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ HPGD P15428 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ALOX5 P09917 2/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL29765212 0.95 ABCB1 (0.37) ABCB1ALDH1A1MAPTKDM4EBCHE
SCHEMBL29307790 0.93 MAPT (0.34) ALDH1A1MAPTKDM4ELMNANPSR1
SCHEMBL21382500 0.84 PDE10A (0.38) ALDH1A1MAPTKDM4ELMNAHPGD
SCHEMBL29307792 0.84 ALDH1A1 (0.34) ALDH1A1MAPTKDM4ELMNANPSR1
SCHEMBL29307771 0.81 BCHE (0.39) ALDH1A1MAPTKDM4EBCHEACHE
SCHEMBL21384684 0.79 PDE3B (0.36) ALDH1A1MAPTKDM4ELMNANPSR1
SCHEMBL29307776 0.74 MAPT (0.39) ALDH1A1MAPTKDM4ELMNANPSR1
SCHEMBL21382072 0.73 PDE3B (0.47) PDE3BPDE3A
SCHEMBL29909986 0.73 PDE3B (0.47) PDE3BPDE3A
SCHEMBL29307955 0.72 ALDH1A1 (0.39) ABCB1ALDH1A1MAPTKDM4EACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12041850-B2 Luminescent compounds Chromatwist Limited (GB) 2024-07-16 — — 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 (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-12041850-B2 Luminescent compounds AHR, ARNT, CYCS ABCB1 1935/4885ALDH1A1 2463/4885MAPT 4531/4885

“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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