SCHEMBL6028992

SCHEMBL6028992

NC(=S)n1cnc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ LMNA P02545 1/20 0.54
▸ STAT6 P42226 1/20 0.54
▸ KMT2A Q03164 3/20 0.49
▸ ASAH1 Q13510 4/20 0.46
▸ HTT P42858 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ DNMT3A Q9Y6K1 1/20 0.44
▸ FGFR1 P11362 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43

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
SCHEMBL250113 0.84 SMN1; SMN2 (0.58) SMN1; SMN2LMNASTAT6KMT2AASAH1
SCHEMBL29833600 0.82 SMN1; SMN2 (0.56) SMN1; SMN2LMNASTAT6KMT2AASAH1
SCHEMBL29833599 0.82 SMN1; SMN2 (0.56) SMN1; SMN2LMNASTAT6KMT2AASAH1
SCHEMBL828619 0.81 KMT2A (0.57) SMN1; SMN2LMNASTAT6KMT2AASAH1
SCHEMBL11882632 0.81 KMT2A (0.57) SMN1; SMN2LMNASTAT6KMT2AASAH1
SCHEMBL5469156 0.81 SMN1; SMN2 (0.54) SMN1; SMN2LMNASTAT6KMT2AASAH1
Methane SCHEMBL8371468 0.79 SMN1; SMN2 (0.53) SMN1; SMN2LMNASTAT6KMT2AASAH1
Bromide SCHEMBL7400039 0.79 KMT2A (0.55) SMN1; SMN2LMNASTAT6KMT2AASAH1
SCHEMBL7611308 0.79 KMT2A (0.55) SMN1; SMN2LMNASTAT6KMT2AASAH1
Hydrochloric Acid SCHEMBL738023 0.79 KMT2A (0.55) SMN1; SMN2LMNASTAT6KMT2AASAH1

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-1709040-A2 FIVE-MEMBERED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF SRC FAMILY PROTEIN KINASE Sirenade Pharmaceuticals AG (DE) 2006-10-11 — — EP disclosed
WO-2005068458-A2 FIVE-MEMBERED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF SRC FAMILY PROTEIN KINASE SIRENADE PHARMACEUTICALS AG (DE) 2005-07-28 — — WO disclosed
US-3980784-A Control of animal parasites with benzimidazoles ELI LILLY AND COMPANY (US) 1976-09-14 — — US disclosed
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