SCHEMBL23974239

SCHEMBL23974239

CC(CC(=O)N(C=O)CCCCCC(=O)NCc1cn(CCOCCOCCOCCOCCOCCNC(=O)COCC(=O)Nc2ccc(COC=O)cc2)nn1)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.38
▸ FOLH1 Q04609 1/20 0.38
▸ SIRT2 Q8IXJ6 2/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ NCOR2 Q9Y618 1/20 0.33
▸ MAP1B P46821 1/20 0.32
▸ F2RL1 P55085 1/20 0.32
▸ DGAT1 O75907 2/20 0.32
▸ PLK1 P53350 2/20 0.32
▸ PLK2 Q9NYY3 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ GHSR Q92847 1/20 0.31
▸ GNRHR P30968 5/20 0.31
▸ ZDHHC20 Q5W0Z9 1/20 0.31

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
SCHEMBL23974353 0.78 FOLH1 (0.43) OPRM1FOLH1F2RL1DGAT1OPRD1
SCHEMBL22299551 0.73 FOLH1 (0.39) OPRM1FOLH1SIRT2HDAC3HDAC1
SCHEMBL24491189 0.72 OPRM1 (0.38) OPRM1FOLH1SIRT2HDAC3HDAC1
SCHEMBL24491155 0.71 OPRM1 (0.37) OPRM1FOLH1SIRT2HDAC3HDAC1
SCHEMBL23974243 0.70 OPRM1 (0.36) OPRM1FOLH1SIRT2HDAC3HDAC1
SCHEMBL22299572 0.69 OPRM1 (0.37) OPRM1FOLH1SIRT2HDAC3HDAC1
SCHEMBL22299956 0.68 FOLH1 (0.38) OPRM1FOLH1F2RL1OPRD1OPRK1
SCHEMBL23974072 0.66 FOLH1 (0.41) OPRM1FOLH1F2RL1OPRD1OPRK1
SCHEMBL24491154 0.66 FOLH1 (0.38) FOLH1
SCHEMBL24491200 0.64 FOLH1 (0.36) FOLH1

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-3903825-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF Coherent Biopharma (Suzhou), Limited (CN) 2021-11-03 — — EP disclosed
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