SCHEMBL10144152

SCHEMBL10144152

Cc1cc(=O)[nH]c2cc(NC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)C(CC3CNc4ccccc43)NC(=O)OCC3c4ccccc4-c4ccccc43)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ TLR2 O60603 2/20 0.37
▸ TLR1 Q15399 1/20 0.37
▸ TPSAB1 Q15661 1/20 0.37
▸ SIRT5 Q9NXA8 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ HDAC4 P56524 2/20 0.35
▸ HDAC1 Q13547 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC10 Q969S8 1/20 0.34
▸ HDAC11 Q96DB2 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC9 Q9UKV0 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
SCHEMBL10144432 0.90 CA1 (0.45) MDM2CA1CA2TLR2TLR1
SCHEMBL10144194 0.89 MDM2 (0.39) MDM2CA1CA2TLR2TLR1
SCHEMBL10143500 0.88 SIRT5 (0.42) MDM2CA1CA2TLR2TLR1
SCHEMBL10143496 0.87 CA1 (0.42) MDM2CA1CA2TLR2TLR1
SCHEMBL10144210 0.87 MDM2 (0.40) MDM2CA1CA2TLR2TLR1
SCHEMBL10144419 0.87 MDM2 (0.41) MDM2CA1CA2TPSAB1TDP1
SCHEMBL10143784 0.86 CA1 (0.37) CA1CA2SIRT5PARP1HDAC4
SCHEMBL10143498 0.85 MDM2 (0.41) MDM2CA1CA2SIRT5TDP1
SCHEMBL10143509 0.85 CACNA1B (0.39) MDM2CA1CA2TLR2TLR1
SCHEMBL10143543 0.85 CTSS (0.40) MDM2CA1CA2TPSAB1SIRT5

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
WO-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 — — WO disclosed
Send feedback