SCHEMBL14239679

SCHEMBL14239679

CC(C)(C)OC(=O)N1CCC(c2ccnc(Nc3ncc(/C=C/c4ccccc4)s3)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.43
WNT3A P56704 1/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
ALK Q9UM73 1/20 0.42
HPGDS O60760 1/20 0.41
JAK3 P52333 4/20 0.40
PTK2 Q05397 4/20 0.40
JAK2 O60674 3/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
GPR119 Q8TDV5 2/20 0.40
SYK P43405 1/20 0.39
IGF1R P08069 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL15641297 1.00 NAMPT (0.43) NAMPTWNT3ADDB1CRBNALK
SCHEMBL14240396 0.85 DDB1 (0.45) NAMPTWNT3ADDB1CRBNALK
SCHEMBL15641277 0.84 DDB1 (0.46) NAMPTWNT3ADDB1CRBNALK
SCHEMBL14240418 0.82 ALK (0.46) NAMPTWNT3ADDB1CRBNALK
SCHEMBL14239643 0.80 KDR (0.46) WNT3ADDB1CRBNHPGDSGPR119
SCHEMBL14240527 0.80 DDB1 (0.45) WNT3ADDB1CRBNALKJAK3
SCHEMBL15641241 0.79 ABL1 (0.49)
SCHEMBL14240654 0.79 ABL1 (0.49)
SCHEMBL14240395 0.79 PKMYT1 (0.47) NAMPTWNT3AALKMAPTLMNA
SCHEMBL14240653 0.79 WNT3A (0.45) WNT3ADDB1CRBNALKJAK3

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-2719696-A1 NOVEL KINASE INHIBITORS Asinex Limited (RU) 2014-04-16 EP disclosed
WO-2012169934-A1 NOVEL KINASE INHIBITORS ОБЩЕСТВО С ОГРАНИЧЕННОЙ ОТВЕТСТВЕННОСТЬЮ "АСИНЭКС МЕДХИМ" (RU) 2012-12-13 WO disclosed