SCHEMBL16897953

SCHEMBL16897953

CCNCc1nc(N)c[nH]1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HRH4 Q9H3N8 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31

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
SCHEMBL13970787 0.78 KDM4E (0.35) KDM4EGAAHRH4HRH3
SCHEMBL1199229 0.77
SCHEMBL16897951 0.71 NOS2 (0.42) HRH3
SCHEMBL13970742 0.70 SMN1; SMN2 (0.42)
SCHEMBL29794191 0.68 NOS2 (0.40) KDM4EHRH4HRH3
SCHEMBL1040322 0.64
SCHEMBL29794166 0.63 ALDH1A1 (0.48)
SCHEMBL6591545 0.63 GABRA5 (0.41) KDM4EGAA
SCHEMBL5469222 0.61 TAAR1 (0.47) KDM4EGAAHRH3
SCHEMBL29794154 0.61 ALDH1A1 (0.43) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3092255-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING EGFR EXPRESSING TUMORS Birdie Biopharmaceuticals Inc. (KY) 2016-11-16 EP disclosed
WO-2015103990-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING EGFR EXPRESSING TUMORS SHANGHAI BIRDIE BIOTECH, INC. (CN) 2015-07-16 WO disclosed