SCHEMBL14214734

SCHEMBL14214734

COc1cc(Nc2ncnc(-c3ccc(C)cc3)n2)cc(OC)c1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.57
EPHB4 P54760 2/20 0.57
TEK Q02763 1/20 0.56
KDR P35968 4/20 0.55
AURKB Q96GD4 2/20 0.55
TBK1 Q9UHD2 2/20 0.54
PTK2 Q05397 7/20 0.53
EGFR P00533 2/20 0.53
TUBB4A P04350 1/20 0.53
TUBB P07437 1/20 0.53
TUBA3C P0DPH7 1/20 0.53
TUBA1B P68363 1/20 0.53
TUBA4A P68366 1/20 0.53
TUBB4B P68371 1/20 0.53
TUBB3 Q13509 1/20 0.53
TUBB2A Q13885 1/20 0.53
TUBB8 Q3ZCM7 1/20 0.53
TUBA3E Q6PEY2 1/20 0.53
TUBA1A Q71U36 1/20 0.53
TUBA1C Q9BQE3 1/20 0.53

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
SCHEMBL14214557 0.83 EPHB4 (0.59) IGF1REPHB4TEKKDRAURKB
SCHEMBL14214679 0.81 PRKD3 (0.69) IGF1REPHB4TEKKDRAURKB
SCHEMBL2322576 0.81 EPHB4 (0.59) IGF1REPHB4TEKKDRAURKB
SCHEMBL14214559 0.80 TEK (0.52) IGF1REPHB4TEKKDRAURKB
SCHEMBL2281989 0.77 AURKB (0.67) IGF1REPHB4TEKKDRAURKB
SCHEMBL21204434 0.76 TBK1 (0.78) TBK1JAK2
SCHEMBL6479711 0.76 TEK (0.73) IGF1REPHB4TEKKDRAURKB
SCHEMBL14214558 0.76 ZAP70 (0.73) TEKTBK1EGFRLCKPRKD3
SCHEMBL14214684 0.76 ZAP70 (0.73) IGF1REPHB4TEKKDRAURKB
SCHEMBL6480192 0.75 IGF1R (0.65) IGF1REPHB4TEKKDRAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed