SCHEMBL10652126

SCHEMBL10652126

O=C(O)OC1CSc2sccc2C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
FABP7 O15540 1/20 0.31
FABP5 Q01469 1/20 0.31
DAO P14920 1/20 0.30
ACE P12821 1/20 0.30

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
SCHEMBL10656312 0.77 KMT2A (0.31) KMT2ADAO
SCHEMBL10539247 0.77 KMT2A (0.38) KMT2AACE
SCHEMBL9219428 0.74 FABP7 (0.39) KMT2AFABP7FABP5
SCHEMBL9218695 0.70 PTPN1 (0.40) KMT2A
SCHEMBL9220559 0.70 MALT1 (0.43) KMT2AFABP7FABP5
SCHEMBL9209686 0.70 FABP7 (0.36) FABP7FABP5
SCHEMBL10543054 0.70 NOS3 (0.33)
SCHEMBL9213539 0.68 RYR2 (0.47)
SCHEMBL9219110 0.68 FABP5 (0.43) FABP7FABP5
SCHEMBL9824427 0.68 CA1 (0.40)

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-0280268-A1 Thienothiopyrans CIBA-GEIGY AG (CH) 1988-08-31 EP disclosed