SCHEMBL8308341

SCHEMBL8308341

Cn1ccnc1Sc1ccc(Nc2ncnc3ccc(O)cc23)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.50
MAP2K1 Q02750 9/20 0.49
EGFR P00533 3/20 0.47
ALK Q9UM73 1/20 0.44
RIPK2 O43353 2/20 0.44
RAF1 P04049 1/20 0.43
BRAF P15056 1/20 0.43

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
SCHEMBL8308906 0.89 EGFR (0.46) EGFRALKRIPK2RAF1BRAF
SCHEMBL7245075 0.84 EGFR (0.55) IGF1RMAP2K1EGFR
Hydrochloric Acid SCHEMBL8310540 0.84 EGFR (0.50) IGF1RMAP2K1EGFR
SCHEMBL8309667 0.84 IGF1R (0.67) IGF1RMAP2K1EGFR
Hydrochloric Acid SCHEMBL8304910 0.83 IGF1R (0.66) IGF1RMAP2K1EGFR
SCHEMBL7232289 0.82 EGFR (0.56) EGFR
SCHEMBL8615048 0.79 IGF1R (0.50) IGF1RMAP2K1
SCHEMBL3808055 0.78 EGFR (0.47) IGF1RMAP2K1EGFR
SCHEMBL5568727 0.77 EGFR (0.49) IGF1RMAP2K1EGFR
SCHEMBL8811673 0.76 ALK (0.43) EGFRALKRAF1BRAF

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-0790986-B1 ANILINE DERIVATIVES ZENECA LTD (GB) 1999-01-20 EP disclosed
EP-0790986-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1997-08-27 EP disclosed
WO-1996015118-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1996-05-23 WO disclosed