SCHEMBL7757535

SCHEMBL7757535

Cc1ccc(OC(=S)S)cc1.[Na]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
GAA P10253 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
ACHE P22303 2/20 0.42
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 3/20 0.40
PTK2B Q14289 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL10665006 0.98 LMNA (0.52) LMNAGAAKDM4EMAPTTHRB
SCHEMBL29113077 0.95 LMNA (0.50) LMNAGAAKDM4EMAPTTHRB
SCHEMBL28413733 0.79 CA1 (0.52) MAPTACHEALDH1A1HPGDSMN1; SMN2
SCHEMBL5655838 0.78 LMNA (0.56) LMNAGAAKDM4EMAPTTHRB
SCHEMBL1401005 0.76 LMNA (0.54) LMNAGAAKDM4EMAPTTHRB
SCHEMBL2000856 0.74 LMNA (0.52) LMNAGAAKDM4EMAPTTHRB
SCHEMBL11485692 0.74 LMNA (0.52) LMNAGAAKDM4EMAPTTHRB
SCHEMBL1401003 0.74 LMNA (0.58) LMNAGAAKDM4EMAPTTHRB
SCHEMBL11485695 0.74 LMNA (0.52) LMNAGAAKDM4EMAPTTHRB
SCHEMBL28673744 0.74 ESR2 (0.46) LMNAGAAKDM4EMAPTTHRB

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-0798313-B1 OLEFIN POLYMERIZATION CATALYST ASAHI CHEMICAL IND (JP) 2001-03-21 EP disclosed