SCHEMBL10375360

SCHEMBL10375360

O=C(O)CCc1cn(CCNS(=O)(=O)c2ccc(Cl)cc2)c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 4/20 0.58
KCNH2 Q12809 2/20 0.56
TBXA2R P21731 2/20 0.53
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
YES1 P07947 2/20 0.47
KDR P35968 2/20 0.47
JAK3 P52333 2/20 0.47
TBXAS1 P24557 1/20 0.46

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
SCHEMBL10494268 0.93 KCNA5 (0.65) KCNA5KCNH2TBXA2RHDAC3HDAC4
SCHEMBL10374845 0.90 LMNA (0.52) KCNA5KCNH2HDAC3HDAC4HDAC1
SCHEMBL10374719 0.90 KCNA5 (0.58) KCNA5KCNH2HDAC3HDAC4HDAC1
SCHEMBL698959 0.85 KCNA5 (0.71) KCNA5KCNH2TBXA2RHDAC3HDAC4
SCHEMBL9814888 0.85 KCNA5 (0.56) KCNA5KCNH2TBXA2RHDAC3HDAC4
SCHEMBL10372455 0.84 TBXAS1 (0.49) KCNA5TBXA2RTBXAS1
SCHEMBL10371704 0.84 KCNA5 (0.55) KCNA5KCNH2TBXA2RMCL1
SCHEMBL698228 0.83 KCNA5 (0.64) KCNA5KCNH2TBXA2RHDAC3HDAC4
SCHEMBL9362957 0.82 KCNA5 (0.54) KCNA5KCNH2HDAC3HDAC4HDAC1
SCHEMBL9363306 0.82 KCNA5 (0.65) KCNA5KCNH2HDAC3HDAC4HDAC1

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
EP-0251011-B1 INDOLYL PROPIONIC ACIDS BAYER AG (DE) 1990-10-24 EP disclosed
US-4843091-A Indolylpropionic acids, compositions of, and use thereof to inhibit thrombocyte aggregation BAYER AKTIENGESELLSCHAFT (DE) 1989-06-27 US disclosed