SCHEMBL3361696

SCHEMBL3361696

O=C1[N]C=Cc2cc(-c3ccccc3)nc(Nc3ccc(CCN4CCOCC4)cc3)c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.43
ZAP70 P43403 1/20 0.43
JAK2 O60674 1/20 0.40
EGFR P00533 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
ACP1 P24666 3/20 0.39
AVPR1B P47901 2/20 0.39
PLK1 P53350 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
IGF1R P08069 2/20 0.39
CDK1 P06493 2/20 0.38

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
SCHEMBL3358542 0.90 SYK (0.42) SYKZAP70EGFRABL1BCR
SCHEMBL3359920 0.86 IGF1R (0.39) SYKZAP70EGFRABL1BCR
SCHEMBL3359073 0.86 TNIK (0.42) SYKZAP70EGFRABL1BCR
SCHEMBL1047753 0.76 ZAP70 (0.74) SYKZAP70JAK2
SCHEMBL3359957 0.74 SYK (0.43) SYKZAP70JAK2EGFRABL1
SCHEMBL3360194 0.74 SRC (0.46) SYKEGFR
SCHEMBL3361210 0.73 SRC (0.42) SYKJAK2EGFRKDR
SCHEMBL3362036 0.73 MAP3K11 (0.37) SYKZAP70EGFRKDR
SCHEMBL3359445 0.73 ZAP70 (0.46) SYKZAP70JAK2MAPT
SCHEMBL3360211 0.73 JAK2 (0.41) SYKJAK2

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-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO disclosed