SCHEMBL11351745

SCHEMBL11351745

CCOC(=O)c1[nH]nc(C)c1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.58
▸ HPGD P15428 4/20 0.58
▸ MAPT P10636 4/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ LMNA P02545 3/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ GAA P10253 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ HPGDS O60760 1/20 0.51
▸ CHEK1 O14757 1/20 0.50
▸ AKT2 P31751 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ XBP1 P17861 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL3493236 0.87 HPGDS (0.60) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL6852927 0.86 ALDH1A1 (0.55) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL5317799 0.86 TRPM8 (0.49) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL16112290 0.82 ALDH1A1 (0.55) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL27518675 0.81 AKT2 (0.59) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL27321802 0.79 RAB9A (0.63) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL3496121 0.79 MAPT (0.48) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL1753182 0.78 HPGDS (0.60) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL10172532 0.78 HPGDS (0.60) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL5330670 0.78 HPGDS (0.56) ALDH1A1HPGDMAPTSMN1; SMN2LMNA

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
EP-0041322-A1 m-Pyrazolylamido tetramisole derivatives, compositions thereof, processes for production of such compounds and compositions and their use in treating helminthiasis BEECHAM GROUP PLC (GB) 1981-12-09 — — EP disclosed
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