SCHEMBL27612489

SCHEMBL27612489

CC(C)(C)OC(=O)NCc1conc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.46
▸ SKP1 P63208 2/20 0.46
▸ SKP2 Q13309 2/20 0.46
▸ GABRA5 P31644 3/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ KDM4A O75164 1/20 0.43
▸ HDAC1 Q13547 1/20 0.42
▸ KCNA5 P22460 1/20 0.42
▸ IDO1 P14902 2/20 0.41
▸ NAMPT P43490 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ S1PR1 P21453 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
SCHEMBL5378376 0.77 CYP17A1 (0.54) GABRA5HDAC1NAMPTHDAC10HDAC6
SCHEMBL30159605 0.76 KCNA5 (0.56) KDM4AHDAC1KCNA5IDO1NAMPT
SCHEMBL8018113 0.76 KCNA5 (0.56) KDM4AHDAC1KCNA5IDO1NAMPT
SCHEMBL25551904 0.75 CKS1B (0.51) CKS1BSKP1SKP2GABRA5CYP1A2
SCHEMBL30036979 0.73 CKS1B (0.49) CKS1BSKP1SKP2GABRA5CYP1A2
SCHEMBL25551937 0.73 CKS1B (0.49) CKS1BSKP1SKP2GABRA5CYP1A2
SCHEMBL1691047 0.73 HDAC1 (0.67) KDM4AHDAC1NAMPTMEN1NPC1
SCHEMBL2121025 0.72 SMN1; SMN2 (0.53) CYP1A2KDM4ANPC1GAARAB9A
SCHEMBL28129413 0.72 NAMPT (0.58) CKS1BSKP1SKP2HDAC1NAMPT
SCHEMBL28646590 0.72 HDAC1 (0.59) KDM4AHDAC1KCNA5CA12CA1

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
CN-1617858-A Pyrimidine derivatives as modulators of insulin-like growth factor-1 receptor (igf-1) ASTRAZENECA AB (SE) 2005-05-18 — — CN disclosed
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