SCHEMBL9145266

SCHEMBL9145266

C=CCNC(=S)NN=C1SCC(=O)N1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.47
▸ GAA P10253 4/20 0.47
▸ MAPT P10636 3/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ LMNA P02545 3/20 0.38
▸ POLB P06746 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TSHR P16473 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PTBP1 P26599 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ TDP1 Q9NUW8 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
SCHEMBL9053850 0.84 LMNA (0.48) ALDH1A1GAAMAPTNPSR1KDM4E
SCHEMBL10814618 0.82 ALDH1A1 (0.47) ALDH1A1GAAMAPTNPSR1KDM4E
SCHEMBL10812313 0.81 MAPK1 (0.39) ALDH1A1GAAMAPTNPSR1KDM4E
SCHEMBL12186945 0.72 LMNA (0.49) ALDH1A1MAPTNPSR1KDM4EMAPK1
SCHEMBL9053874 0.72 LMNA (0.49) ALDH1A1MAPTNPSR1KDM4EMAPK1
SCHEMBL733447 0.70 MAPK1 (0.41) ALDH1A1GAAMAPTNPSR1KDM4E
SCHEMBL9054381 0.69 ALDH1A1 (0.44) ALDH1A1GAAMAPTNPSR1KDM4E
SCHEMBL9054133 0.68 LMNA (0.45) ALDH1A1MAPTNPSR1KDM4EMAPK1
SCHEMBL9053887 0.67 ALDH1A1 (0.39) ALDH1A1GAAMAPTNPSR1KDM4E
SCHEMBL9494274 0.64 LMNA (0.52) ALDH1A1GAAMAPTNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5378719-A Antiarthritic agents; rheumatic diseases CIBA-GEIGY CORPORATION (US) 1995-01-03 — — US disclosed
EP-0548018-A1 Imidazoles CIBA-GEIGY AG (CH) 1993-06-23 — — EP disclosed
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