SCHEMBL6980980

SCHEMBL6980980

Cn1cc(CC(=O)O)c2ccccc21.O=C(O)c1ccc(I)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
CDC25A P30304 1/20 0.49
GPR84 Q9NQS5 1/20 0.48
CMA1 P23946 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PTPN5 P54829 1/20 0.46
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL341492 0.86 GPR84 (0.62) KDM4ECDC25AGPR84CMA1MEN1
SCHEMBL29623334 0.86 GPR84 (0.62) KDM4ECDC25AGPR84CMA1MEN1
SCHEMBL22768845 0.79 GPR84 (0.61) KDM4EGPR84CMA1MEN1KMT2A
SCHEMBL8260034 0.74 GPR84 (0.62) KDM4EGPR84MEN1KMT2APTPN5
SCHEMBL23175314 0.73 GPR84 (0.61) KDM4EGPR84MEN1KMT2APTPN5
SCHEMBL30958421 0.73 ICMT (0.62) KDM4EGPR84MEN1KMT2APTPN5
SCHEMBL588980 0.73 ICMT (0.62) KDM4EGPR84MEN1KMT2APTPN5
SCHEMBL29623198 0.73 GPR84 (0.61) KDM4EGPR84MEN1KMT2APTPN5
SCHEMBL15143088 0.72 POLB (0.77) MEN1KMT2ALMNAMAPTALDH1A1
Hydrochloric Acid SCHEMBL3155846 0.72 ICMT (0.60) KDM4EGPR84MEN1KMT2APTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218343-A4 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2003-06-18 EP disclosed
EP-1218343-A1 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-07-03 EP disclosed
WO-2001025203-A1 PYRIDINE CARBOXAMIDE OR SULFONAMIDE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-04-12 WO disclosed