SCHEMBL31681968

SCHEMBL31681968

CC(C)(C)OC(=O)CCCCCCCCCc1ccc(OCc2ccc(S(=O)(=O)Nc3cnc(C(=O)O)nc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ HDAC8 Q9BY41 1/20 0.46
▸ AR P10275 7/20 0.42
▸ ADAMTS4 O75173 1/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ RXRA P19793 1/20 0.40
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ PSEN1 P49768 1/20 0.40
▸ PSEN2 P49810 1/20 0.40
▸ APH1B Q8WW43 1/20 0.40
▸ NCSTN Q92542 1/20 0.40
▸ APH1A Q96BI3 1/20 0.40
▸ PSENEN Q9NZ42 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ ADRB3 P13945 1/20 0.39
▸ BCL2 P10415 1/20 0.39

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
SCHEMBL31682111 1.00 POLB (0.50) POLBTDP1HDAC8ARADAMTS4
SCHEMBL31682053 0.94 HDAC1 (0.44) POLBTDP1HDAC8PSEN1PSEN2
SCHEMBL31682055 0.94 HDAC1 (0.44) POLBTDP1HDAC8PSEN1PSEN2
SCHEMBL31682026 0.93 HDAC1 (0.43) POLBTDP1HDAC8PSEN1PSEN2
SCHEMBL22029370 0.93 TDP1 (0.41) POLBTDP1HDAC8PSEN1PSEN2
SCHEMBL31682042 0.91 HDAC1 (0.46) POLBTDP1HDAC8PSEN1PSEN2
SCHEMBL31682121 0.88 HDAC1 (0.50) TDP1HDAC8PKMPSEN1PSEN2
SCHEMBL22029393 0.88 HDAC1 (0.50) TDP1HDAC8PKMPSEN1PSEN2
SCHEMBL31682017 0.88 HDAC1 (0.50) TDP1HDAC8PKMPSEN1PSEN2
SCHEMBL31682034 0.87 TDP1 (0.46) POLBTDP1HDAC8ARADAMTS4

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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