SCHEMBL7804119

SCHEMBL7804119

CC(NC(c1ccc(Cl)cc1)c1ccccc1Nc1c(O)c(=O)c1=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 7/20 0.41
CXCR1 P25024 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CCR6 P51684 2/20 0.40
CXCL8 P10145 2/20 0.39
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
SLC6A9 P48067 1/20 0.35
SLC6A5 Q9Y345 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
CRHBP P24387 1/20 0.35
MAPK1 P28482 1/20 0.35
CRHR2 Q13324 1/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
GPR139 Q6DWJ6 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
SCHEMBL7795443 1.00 CXCR2 (0.41) CXCR2CXCR1MEN1KMT2ACCR6
SCHEMBL7801221 0.89 CXCR2 (0.41) CXCR2CXCR1CCR6CXCL8CYP3A4
Hydrochloric Acid SCHEMBL7801287 0.88 CXCR2 (0.41) CXCR2CXCR1CCR6CXCL8CYP3A4
SCHEMBL7801220 0.86 LMNA (0.38) CXCR2CXCR1MEN1KMT2ACCR6
Hydrochloric Acid SCHEMBL7802250 0.86 LMNA (0.37) CXCR2CXCR1MEN1KMT2ACCR6
Hydrochloric Acid SCHEMBL7804207 0.85 CCR6 (0.36) CXCR2CXCR1MEN1KMT2ACCR6
SCHEMBL7787711 0.81 CXCR2 (0.41) CXCR2MEN1KMT2ACYP3A4CYP2C9
SCHEMBL7787459 0.81 CXCR2 (0.41) CXCR2MEN1KMT2ACYP3A4CYP2C9
SCHEMBL7801434 0.81 CXCR2 (0.40) CXCR2CXCR1CCR6LMNAGPR139
SCHEMBL7805393 0.81 CXCR2 (0.40) CXCR2CXCR1MEN1KMT2ACCR6

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-1070703-A1 Cyclobutene derivatives Sankyo Company Limited (JP) 2001-01-24 EP disclosed