SCHEMBL23520609

SCHEMBL23520609

CCOC(CNc1ccccc1Br)OCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ HPGD P15428 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ EPHX1 P07099 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ANPEP P15144 1/20 0.33
▸ ATM Q13315 3/20 0.33
▸ HTR3E A5X5Y0 1/20 0.32
▸ HTR3B O95264 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ CHRM5 P08912 1/20 0.32
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ HRH1 P35367 1/20 0.32
▸ CHRNA7 P36544 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
SCHEMBL248759 0.79 L3MBTL1 (0.44) KMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL27895396 0.77 TSHR (0.50) HPGDALDH1A1L3MBTL1
SCHEMBL28607126 0.76 IDO1 (0.49) KMT2ABCHECES1ALDH1A1L3MBTL1
SCHEMBL7850850 0.75 GAA (0.43) KMT2AMEN1HPGDALDH1A1MAPT
SCHEMBL935506 0.74 MAPT (0.49) KMT2AMEN1ALDH1A1L3MBTL1EPHX1
SCHEMBL1976303 0.73 IDO1 (0.44) KMT2AMEN1HPGDBCHECES1
SCHEMBL26674812 0.72 L3MBTL1 (0.38) KMT2AMEN1BCHECES1ALDH1A1
Bromide SCHEMBL29155172 0.71 IDO1 (0.42) KMT2AMEN1HPGDBCHECES1
Hydrochloric Acid SCHEMBL29155176 0.71 IDO1 (0.42) KMT2AMEN1HPGDBCHECES1
SCHEMBL7731849 0.71 PDE3B (0.37) KMT2AMEN1HPGDALDH1A1L3MBTL1

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-20210179649-A1 ORGANIC METAL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2021-06-17 — — 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-20210179649-A1 ORGANIC METAL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE MRPL38, L1CAM, IL18 KMT2A 1541/4885MEN1 88/4885HPGD 3648/4885

“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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