SCHEMBL7978027

SCHEMBL7978027

Cc1ccc(-c2[nH]c(-c3ccccc3)nc2C(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.67
ALDH1A1 P00352 3/20 0.67
GLA P06280 3/20 0.67
GAA P10253 3/20 0.67
HPGD P15428 3/20 0.67
KMT2A Q03164 3/20 0.67
MEN1 O00255 2/20 0.67
PIN1 Q13526 5/20 0.65
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
MAPK1 P28482 1/20 0.58
CASP1 P29466 1/20 0.58
RNASEH1 O60930 1/20 0.54
ERCC1 P07992 1/20 0.54
FEN1 P39748 1/20 0.54
ERCC4 Q92889 1/20 0.54
DHODH Q02127 2/20 0.52
MAPT P10636 2/20 0.49
GFER P55789 1/20 0.49
TNKS O95271 1/20 0.49

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
SCHEMBL29093221 0.91 PIN1 (0.69) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7992039 0.88 MAPK14 (0.56) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7977738 0.88 MAPK14 (0.56) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7977763 0.88 CTRC (0.53) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7977705 0.86 DHODH (0.54) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL28576641 0.86 ERCC1 (0.60) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7988191 0.85 NPBWR1 (0.53) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7989975 0.84 DHODH (0.61) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7977380 0.84 MEN1 (0.56) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7992089 0.83 MAPK14 (0.62) PIN1CYP1A2CYP2C19MAPK1CASP1

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
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed