SCHEMBL29799568

SCHEMBL29799568

O=C(O)CCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCOCCOCCOCCO

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.51
▸ PTPN1 P18031 3/20 0.48
▸ TLR2 O60603 4/20 0.47
▸ MDM4 O15151 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CASP3 P42574 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
SCHEMBL26232004 1.00 KMT2A (0.51) KMT2APTPN1TLR2MDM4TP53
SCHEMBL26689394 0.94 KMT2A (0.53) KMT2APTPN1TLR2MDM4TP53
SCHEMBL26689238 0.94 KMT2A (0.53) KMT2APTPN1TLR2MDM4TP53
SCHEMBL26689241 0.94 KMT2A (0.53) KMT2APTPN1TLR2MDM4TP53
SCHEMBL26689396 0.94 KMT2A (0.53) KMT2APTPN1TLR2MDM4TP53
SCHEMBL31287180 0.92 KMT2A (0.50) KMT2APTPN1TLR2CASP3
SCHEMBL26232021 0.92 KMT2A (0.50) KMT2APTPN1TLR2CASP3
SCHEMBL31648532 0.92 KMT2A (0.50) KMT2APTPN1TLR2CASP3
SCHEMBL29799591 0.92 KMT2A (0.50) KMT2APTPN1TLR2CASP3
SCHEMBL26981156 0.92 TLR2 (0.51) KMT2APTPN1TLR2CASP3

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-4301415-A1 BRANCHED LINKERS FOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF R.P. Scherer Technologies, LLC (US) 2024-01-10 — — EP disclosed
WO-2022187370-A1 BRANCHED LINKERS FOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF R.P. SCHERER TECHNOLOGIES, LLC (US) 2022-09-09 — — WO disclosed
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