SCHEMBL7861323

SCHEMBL7861323

N#Cc1c(Cl)ccc(N)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 1/20 0.41
CXCR2 P25025 1/20 0.41
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
ESR2 Q92731 1/20 0.34
THRB P10828 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 3/20 0.32

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
SCHEMBL10987754 0.78 ALDH1A1 (0.39) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL6363096 0.78 ALDH1A1 (0.35) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL10984237 0.75 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL5595008 0.75 ALDH1A1 (0.39) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL3561080 0.74 PRKACA (0.42) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL4334905 0.74 ALDH1A1 (0.45) CXCR1CXCR2ALDH1A1KDM4EGAA
SCHEMBL11789185 0.73 ALDH1A1 (0.37) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL29927582 0.72 CA1 (0.48) ALDH1A1GAACA12CA1CA2
SCHEMBL26096976 0.72 CA1 (0.48) ALDH1A1GAACA12CA1CA2
SCHEMBL9575176 0.71 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915651-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2001-10-24 EP disclosed
US-6271261-B1 CHEMOKINE MEDIATED DISEASES, BINDING INTERLEUKINS OR BETA-RECEPTORS AND ADMINISTERING TO MAMMALS SMITHKLINE BEECHAM CORPORATION 2001-08-07 US disclosed
EP-0915651-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-05-19 EP disclosed
WO-1997049286-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-31 WO disclosed