SCHEMBL11088568

SCHEMBL11088568

CCN1CCN(C(=O)NC(C(=O)O)c2cccc(NC(=O)OC(C)(C)C)c2)C(=O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.39
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ ACSS2 Q9NR19 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ PRMT5 O14744 1/20 0.37
▸ WDR77 Q9BQA1 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ BACE1 P56817 2/20 0.35
▸ NPY1R P25929 1/20 0.35
▸ HDAC1 Q13547 2/20 0.35
▸ KAT6A Q92794 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ HDAC2 Q92769 1/20 0.34

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
SCHEMBL11088574 1.00 RORC (0.39) RORCCTSSCTSKPOLBACSS2
SCHEMBL11088569 1.00 RORC (0.39) RORCCTSSCTSKPOLBACSS2
SCHEMBL11088554 0.89 CYP17A1 (0.41) CTSSCTSKPOLBACSS2ATM
SCHEMBL11088548 0.89 CYP17A1 (0.41) CTSSCTSKPOLBACSS2ATM
SCHEMBL11088546 0.89 CYP17A1 (0.41) CTSSCTSKPOLBACSS2ATM
SCHEMBL11083541 0.88 ATM (0.35) CTSSCTSKPOLBATMHDAC1
SCHEMBL11083550 0.88 ATM (0.35) CTSSCTSKPOLBATMHDAC1
SCHEMBL11083551 0.82 BRD4 (0.38) CTSSCTSKPOLBATMHDAC1
SCHEMBL16019036 0.82 KEAP1 (0.37) POLBATMBACE1HDAC1HDAC2
SCHEMBL8597022 0.80 ATM (0.42) POLBATM

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-4464366-A Cephem compounds having a terminal aminocarboxylic acid grouping and containing an azacyclyl(thio)ureido group CIBA GEIGY CORPORATION (US) 1984-08-07 — — US disclosed
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