SCHEMBL30044896

SCHEMBL30044896

CC(=O)c1c(Cl)c2cc(Cl)ccc2[nH]c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.49
MAP2 P11137 1/20 0.49
GRIN2D O15399 2/20 0.49
GRIN3B O60391 2/20 0.49
GRIN1 Q05586 2/20 0.49
GRIN2A Q12879 2/20 0.49
GRIN2B Q13224 2/20 0.49
GRIN2C Q14957 2/20 0.49
GRIN3A Q8TCU5 2/20 0.49
LMNA P02545 1/20 0.49
KDM4E B2RXH2 2/20 0.48
DAO P14920 1/20 0.48
CYP1A2 P05177 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
PARP1 P09874 1/20 0.46
CHEK1 O14757 1/20 0.46
GSK3B P49841 1/20 0.46
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45

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
SCHEMBL23498272 1.00 CSF1R (0.49) CSF1RMAP2GRIN2DGRIN3BGRIN1
SCHEMBL25430492 0.86 SIRT1 (0.52) CSF1RMAP2GRIN2DGRIN3BGRIN1
SCHEMBL31139832 0.86 SIRT1 (0.52) CSF1RMAP2GRIN2DGRIN3BGRIN1
SCHEMBL23510959 0.86 GRIN2D (0.58) CSF1RGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30043560 0.80 MAP2 (0.74) CSF1RMAP2KDM4ECYP1A2HPGD
SCHEMBL6059495 0.80 MAP2 (0.74) CSF1RMAP2KDM4ECYP1A2HPGD
SCHEMBL25432829 0.80 CSF1R (0.48) CSF1RMAP2GRIN2DGRIN3BGRIN1
SCHEMBL30590427 0.80 CSF1R (0.48) CSF1RMAP2GRIN2DGRIN3BGRIN1
SCHEMBL19863777 0.79 CSF1R (0.60) CSF1RMAP2KDM4EGSK3B
SCHEMBL22450909 0.79 MAP2 (0.52) MAP2LMNACYP1A2GAAHPGD

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-4073054-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF TUMORS Fondazione Istituto Italiano di Tecnologia (IT) 2022-10-19 EP disclosed