SCHEMBL19683825

SCHEMBL19683825

N=C(c1ccc(CN2CCOCC2)cc1)c1c(N)ncnc1Nc1ccc(NC=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
MAPK1 P28482 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
ERBB2 P04626 3/20 0.43
EGFR P00533 5/20 0.42
SYK P43405 1/20 0.40
PLK4 O00444 1/20 0.40
CDK2 P24941 1/20 0.40
FLT3 P36888 1/20 0.40
CCNA1 P78396 1/20 0.40
HIF1A Q16665 4/20 0.40
EPAS1 Q99814 4/20 0.40
JAK2 O60674 1/20 0.39
JAK3 P52333 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
SCHEMBL19683744 0.89 CDK4 (0.42) LMNACDK2FLT3CCNA1
SCHEMBL20878933 0.87 TYK2 (0.41) ERBB2EGFRFLT3
SCHEMBL19683782 0.86 EGFR (0.45) SMN1; SMN2KDM4EALDH1A1ERBB2EGFR
SCHEMBL20878968 0.85 SRC (0.44) ERBB2EGFRFLT3JAK3
SCHEMBL20878943 0.85 HPGD (0.44) KDM4EEGFRSYKPLK4FLT3
SCHEMBL19683745 0.82 ALDH1A1 (0.41) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL20878986 0.81 EGFR (0.47) KDM4EALDH1A1TP53TSHRERBB2
SCHEMBL19683752 0.79 PLK4 (0.38) ALDH1A1TSHRSYKPLK4
SCHEMBL20878945 0.79 EIF2AK2 (0.42) NPC1RAB9AERBB2SYKFLT3
SCHEMBL23047341 0.78 PRMT1 (0.42) ALDH1A1ERBB2EGFRCDK2

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-3466952-B1 1-(4-(4-AMINO-3-PHENYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-1-YL)-PHENYL)-UREA DERIVATIVES AS FLT3 KINASE INHIBITORS FOR TREATING CANCER PRECEDO PHARMACEUTICALS CO LTD (CN) 2021-03-03 EP disclosed
EP-3466952-A1 NOVEL INHIBITOR FOR FLT3 KINASE AND USES THEREOF Precedo Pharmaceuticals Co., Ltd. (CN) 2019-04-10 EP disclosed
WO-2017206962-A1 NOVEL INHIBITOR FOR FLT3 KINASE AND USES THEREOF 合肥中科普瑞昇生物医药科技有限公司 2017-12-07 WO disclosed