SCHEMBL10463307

SCHEMBL10463307

O=C(O)CCC(=O)c1ccc(CCNS(=O)(=O)CCc2ccc(Cl)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
AKR1C3 P42330 1/20 0.46
HSD11B1 P28845 1/20 0.45
MMP8 P22894 1/20 0.44
MMP12 P39900 1/20 0.44
MMP13 P45452 1/20 0.44
TBXAS1 P24557 1/20 0.44
PRMT1 Q99873 1/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 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
SCHEMBL9659280 0.85 TBXA2R (0.70) TBXA2RMEN1KMT2AAKR1C3TBXAS1
SCHEMBL10463756 0.84 KMT2A (0.52) L3MBTL1MEN1KMT2AHTTALDH1A1
SCHEMBL11102786 0.83 TBXA2R (0.71) TBXA2RL3MBTL1MEN1KMT2AAKR1C3
SCHEMBL10867378 0.81 ALDH1A1 (0.56) TBXA2RL3MBTL1TBXAS1ALDH1A1MAPT
SCHEMBL10462670 0.80 GAA (0.50) TBXA2RL3MBTL1MEN1KMT2AAKR1C3
SCHEMBL10462201 0.78 ALDH1A1 (0.64) TBXA2RTBXAS1PRMT1ALDH1A1MAPT
SCHEMBL10462267 0.78 TBXA2R (0.67) TBXA2RMEN1KMT2AAKR1C3TBXAS1
SCHEMBL11339358 0.78 TBXA2R (0.60) TBXA2RMMP8MMP12MMP13TBXAS1
SCHEMBL8487453 0.77 MMP8 (0.70) TBXA2RMEN1KMT2AAKR1C3MMP8
SCHEMBL10460357 0.76 AKR1C3 (0.63) TBXA2RMEN1KMT2AAKR1C3HSD11B1

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
US-4948809-A TREATMENT OF AILMENTS DUE TO THROMBOCYTE AGGREGATION OR KIDNEY DYSFUNCTION BOEHRINGER MANNHEIM GMBH (DE) 1990-08-14 US disclosed