SCHEMBL1126655

SCHEMBL1126655

Cc1[nH]c(C(=O)C(=O)Cl)c(-c2ccccc2)c1Cc1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.42
KDM4E B2RXH2 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CDC7 O00311 1/20 0.36
PDE10A Q9Y233 1/20 0.36
FNTA P49354 4/20 0.36
FNTB P49356 4/20 0.36
GSK3B P49841 1/20 0.35
MAP2 P11137 1/20 0.35
IMPDH2 P12268 1/20 0.35
MMP13 P45452 1/20 0.34
MAPT P10636 1/20 0.34
STAT1 P42224 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 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
SCHEMBL1127399 0.76 LMNA (0.35) KDM4EHTTTDP1MAP2MAPT
SCHEMBL1126936 0.74 CSF1R (0.39) KDM4EHTTSMN1; SMN2TDP1MAPT
SCHEMBL1126894 0.74 LMNA (0.48) HTTSMN1; SMN2MAPTRAB9AALDH1A1
SCHEMBL1127186 0.74 MTNR1A (0.45) KDM4ESMN1; SMN2TDP1MAPTRAB9A
SCHEMBL1127408 0.74 RAB9A (0.39) KDM4EHTTSMN1; SMN2TDP1MAPT
SCHEMBL1127778 0.74 LMNA (0.39) KDM4EHTTTDP1MAPTSTAT1
SCHEMBL1126902 0.73 LMNA (0.38) KDM4EHTTSMN1; SMN2TDP1MAPT
SCHEMBL1127366 0.72 LMNA (0.37) KDM4ESMN1; SMN2TDP1MAPTSTAT1
SCHEMBL1126974 0.68 LMNA (0.43) HTTSMN1; SMN2TDP1MAPTSTAT1
SCHEMBL1126648 0.66 CSF1R (0.37) KDM4EHTTSMN1; SMN2MAPTRAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2283006-A1 PYRROLE ANTIFUNGAL AGENTS F2G Limited (GB) 2011-02-16 EP disclosed
WO-2009130481-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2009-10-29 WO disclosed