SCHEMBL5965299

SCHEMBL5965299

CC(Cn1cccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.50
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ GFER P55789 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ AOC3 Q16853 2/20 0.45
▸ DAO P14920 1/20 0.45
▸ TRPA1 O75762 4/20 0.44
▸ RIPK1 Q13546 1/20 0.44

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
SCHEMBL12310232 0.79 TAAR1 (0.47) TAAR1KDM4EALDH1A1GFERL3MBTL1
SCHEMBL11079263 0.77 CYP19A1 (0.58) —
SCHEMBL27678035 0.74 TSHR (0.59) KDM4EL3MBTL1AOC3DAO
SCHEMBL27678037 0.74 TSHR (0.59) KDM4EL3MBTL1AOC3DAO
SCHEMBL8267685 0.71 ALDH1A1 (0.69) KDM4EALDH1A1GFERL3MBTL1
SCHEMBL6280516 0.71 RIPK1 (0.67) TAAR1AOC3TRPA1RIPK1
SCHEMBL3672929 0.71 TRPA1 (0.67) TAAR1KDM4EALDH1A1GFERL3MBTL1
SCHEMBL7792404 0.69 ALDH1A1 (0.67) KDM4EALDH1A1GFERL3MBTL1
SCHEMBL3749040 0.69 DAO (0.49) TAAR1KDM4EALDH1A1GFERL3MBTL1
Benzene SCHEMBL5290987 0.69 TAAR1 (0.61) TAAR1ALDH1A1AOC3TRPA1RIPK1

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-20060263639-A1 ORGANIC ELECTROLUMINESCENCE MATERIAL AND ELECTROLUMINESCENCE DEVICE USING THE SAME SAMSUNG SDI CO., LTD. (KR) 2006-11-23 — — 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-20060263639-A1 ORGANIC ELECTROLUMINESCENCE MATERIAL AND ELECTROLUMINESCENCE DEVICE USING THE SAME ELAVL1, L1CAM, ELOB TAAR1 664/4885KDM4E 2677/4885ALDH1A1 100/4885

“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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