SCHEMBL6598526

SCHEMBL6598526

O=C1CCC(=O)N1CCCCCSn1cnc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 2/20 0.38
▸ MKNK2 Q9HBH9 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ALPL P05186 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTR1A P08908 3/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ EGLN3 Q9H6Z9 1/20 0.35
▸ ASAH1 Q13510 1/20 0.34
▸ HTR7 P34969 2/20 0.34
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34

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
SCHEMBL6599113 0.86 GSK3A (0.39) MKNK1MKNK2LMNATDP1ALDH1A1
SCHEMBL6590472 0.77 MAPK1 (0.50) MKNK1LMNARAB9ATSHRPOLB
SCHEMBL10735469 0.74 TDP1 (0.43) LMNATDP1SMN1; SMN2ALOX15TSHR
SCHEMBL11140162 0.74 ASAH1 (0.47) LMNATDP1SMN1; SMN2TSHRSLC6A4
SCHEMBL6530090 0.70 TDP1 (0.46) LMNATDP1SMN1; SMN2POLBEGLN3
SCHEMBL8792548 0.70 TDP1 (0.46) LMNATDP1SMN1; SMN2TSHRHPGD
SCHEMBL11451311 0.68 TDP1 (0.46) LMNATDP1SMN1; SMN2TSHRPOLB
SCHEMBL8413080 0.67 TDP1 (0.48) LMNATDP1SMN1; SMN2ALDH1A1POLB
SCHEMBL9060998 0.67 TDP1 (0.48) LMNATDP1SMN1; SMN2TSHRHPGD
Hydrochloric Acid SCHEMBL699486 0.67 LMNA (0.49) MKNK1LMNARAB9AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1201664-B1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2004-09-08 — — EP disclosed
US-6593323-B1 Benzimidazole compound inhibitory action of forming of macrophages and is useful as an active ingredient of a medicament for preventive and/or therapeutic treatment of arteriosclerosis, which is represented by the formula (I): FUJI PHOTO FILM CO., LTD. (JP) 2003-07-15 — — US disclosed
EP-1201664-A1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME FUJI PHOTO FILM CO., LTD. (JP) 2002-05-02 — — EP disclosed
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