SCHEMBL9730282

SCHEMBL9730282

O=C(CBr)Nc1ccc(Br)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.46
▸ KMT2A Q03164 6/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SNCA P37840 1/20 0.46
▸ RAB9A P51151 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ ERCC1 P07992 1/20 0.44
▸ ERCC4 Q92889 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ GSTO1 P78417 1/20 0.42
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ POLB P06746 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
SCHEMBL4003419 0.81 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL15627957 0.80 ALDH1A1 (0.73) ALDH1A1KMT2AHPGDRAB9AL3MBTL1
SCHEMBL15267699 0.78 KMT2A (0.60) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL879793 0.78 PKM (0.59) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL8590851 0.78 NLRP3 (0.56) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL9300058 0.77 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL32665481 0.77 TSHR (0.45) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL13814503 0.77 KMT2A (0.43) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL21765860 0.77 MAPT (0.59) ALDH1A1KMT2AMEN1LMNAHPGD
SCHEMBL4256850 0.77 MAPT (0.61) KMT2AMEN1LMNARAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5136868-A HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF FMC CORPORATION (US) 1992-08-11 — — US disclosed
EP-0161304-B1 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF FMC Corporation (US) 1990-01-10 — — EP disclosed
EP-0161304-A4 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF. FMC CORP (US) 1986-04-15 — — EP disclosed
EP-0161304-A1 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF. FMC CORP (US) 1985-11-21 — — EP disclosed
WO-1985001939-A1 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF FMC CORPORATION (US) 1985-05-09 — — WO disclosed
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