SCHEMBL10876269

SCHEMBL10876269

O=C(c1cccs1)c1[nH]c(=O)[nH]c1CBr

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.42
▸ HPGD P15428 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ LMNA P02545 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ CES2 O00748 2/20 0.41
▸ CES1 P23141 2/20 0.41
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ ALOX15 P16050 2/20 0.40
▸ DAO P14920 1/20 0.40

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
SCHEMBL7436437 0.83 HPGD (0.44) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL10879980 0.82 HPGD (0.44) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL10884329 0.80 HPGD (0.40) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL10877089 0.77 MEN1 (0.56) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL7434232 0.73 HPGD (0.43) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL10876599 0.73 PDE3B (0.73) HPGDMEN1KMT2AHSD17B10LMNA
Hydrochloric Acid SCHEMBL11261296 0.71 ALDH1A1 (0.53) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL182010 0.69 CES2 (0.71) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL9787284 0.68 HPGD (0.43) HPGDSHPGDMEN1KMT2AALDH1A1
SCHEMBL11706786 0.67 HPGDS (0.62) HPGDSHPGDMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0065165-B1 5-OXYMETHYL-4-ACYL-1,3-DIHYDRO-2H-IMIDAZOL-2-ONES MERRELL DOW PHARMACEUTICALS INC. (US) 1986-06-18 — — EP disclosed
EP-0064704-B1 4-AMINOMETHYL-5-ACYL-1,3-DIHYDRO-2H-IMIDAZOL-2-ONES MERRELL DOW PHARMACEUTICALS INC. (US) 1986-04-16 — — EP disclosed
US-4526981-A [1,2-Dihydro-4(5)-acyl-2-oxo-2H-imidazol-4(5)-yl] methyl nitrates MERRELL DOW PHARMACEUTICALS INC. (US) 1985-07-02 — — US disclosed
US-4381393-A 4-Aminomethyl-5-acyl-1,3-dihydro-2H-imidazol-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1983-04-26 — — US disclosed
EP-0064704-A1 4-Aminomethyl-5-acyl-1,3-dihydro-2H-imidazol-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-11-17 — — EP disclosed
US-4329471-A CARDIOTONICS, HYPOTENSIVE AGENTS, AND ANTITHROMBOTIC AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1982-05-11 — — US disclosed
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