SCHEMBL31682034

SCHEMBL31682034

CC(C)(C)OC(=O)CCCCCCCCCCCCCc1ccc(OCc2ccc(S(=O)(=O)Nc3ncc(C(=O)O)cn3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.46
▸ POLB P06746 1/20 0.46
▸ HDAC8 Q9BY41 2/20 0.44
▸ ADAMTS4 O75173 1/20 0.41
▸ RXRA P19793 3/20 0.40
▸ NR1H2 P55055 2/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ BCL2 P10415 1/20 0.40
▸ NR4A2 P43354 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ TBXA2R P21731 1/20 0.40
▸ TBXAS1 P24557 1/20 0.40
▸ AR P10275 1/20 0.39
▸ MGLL Q99685 2/20 0.38

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
SCHEMBL31682097 0.94 TBXA2R (0.43) TDP1TBXA2RTBXAS1
SCHEMBL31681966 0.94 TBXA2R (0.43) TDP1TBXA2RTBXAS1
SCHEMBL31682020 0.94 TBXA2R (0.43) TDP1TBXA2RTBXAS1
SCHEMBL31682088 0.93 MCL1 (0.40) TDP1POLBHDAC8TBXA2RTBXAS1
SCHEMBL31681971 0.91 POLB (0.44) TDP1POLBHDAC8ADAMTS4RXRA
SCHEMBL31682078 0.91 POLB (0.44) TDP1POLBHDAC8ADAMTS4RXRA
SCHEMBL26786077 0.88 HDAC1 (0.46) TDP1HDAC8
SCHEMBL31681968 0.87 POLB (0.50) TDP1POLBHDAC8ADAMTS4RXRA
SCHEMBL31682111 0.87 POLB (0.50) TDP1POLBHDAC8ADAMTS4RXRA
SCHEMBL31682115 0.83 BRD4 (0.47) HDAC8TBXA2RTBXAS1

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-3893934-B1 INSULIN CONJUGATES SANOFI SA (FR) 2025-09-10 — — EP disclosed
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