SCHEMBL24926205

SCHEMBL24926205

COc1ccccc1Bc1c(C)cccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.44
▸ CA2 P00918 3/20 0.44
▸ CA7 P43166 2/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ CYP3A4 P08684 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ADRA2B P18089 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ AR P10275 2/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MAPT P10636 2/20 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
SCHEMBL28498389 0.81 CA1 (0.60) CA1CA2CA7CA9CA12
SCHEMBL24925937 0.72 TRPA1 (0.46) CA1CA2CA12CA4CA14
SCHEMBL29355560 0.71 — —
SCHEMBL82813 0.71 — —
SCHEMBL29016357 0.71 CYP1A2 (0.47) CA1CA2CA7CA9CYP3A4
SCHEMBL20154385 0.70 CA1 (0.57) CA1CA2CA7CA9CA12
Fluoride SCHEMBL27964337 0.69 CA1 (0.63) CA1CA2CA7CA9CA12
Ammonia Solution, Strong SCHEMBL27952518 0.69 CA1 (0.63) CA1CA2CA7CA9CA12
SCHEMBL12662425 0.69 CA1 (0.55) CA1CA2CA7CA9CA12
SCHEMBL23050 0.69 CA1 (0.55) CA1CA2CA7CA9CA12

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-20230029347-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-01-26 — — 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-20230029347-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP CA1 4271/4885CA2 3960/4885CA7 3393/4885

“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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