SCHEMBL19683696

SCHEMBL19683696

CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc(N)c3C(=N)c3ccccc3)cc2)no1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 9/20 0.59
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
KMT2A Q03164 1/20 0.57
BRAF P15056 2/20 0.55
RET P07949 5/20 0.55
NTRK1 P04629 2/20 0.53
NTRK3 Q16288 2/20 0.53
NTRK2 Q16620 2/20 0.53
MAPK13 O15264 2/20 0.53
RAF1 P04049 2/20 0.53
MAPK12 P53778 2/20 0.53
MAPK11 Q15759 2/20 0.53
MAPK14 Q16539 1/20 0.53
RIPK1 Q13546 2/20 0.53
KDR P35968 2/20 0.52
MAP3K7 O43318 1/20 0.52
CCNT1 O60563 1/20 0.52
CSF1R P07333 1/20 0.52

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
SCHEMBL20878886 0.93 RAF1 (0.64) FLT3MEN1NPC1RAB9AKMT2A
SCHEMBL20878884 0.92 FLT3 (0.60) FLT3BRAFRETNTRK1NTRK3
SCHEMBL19683603 0.91 FLT3 (0.62) FLT3BRAFRETNTRK1NTRK3
SCHEMBL19683715 0.91 RAF1 (0.59) FLT3BRAFRETNTRK1NTRK3
SCHEMBL19683697 0.90 RET (0.44) FLT3MEN1NPC1RAB9AKMT2A
SCHEMBL19683716 0.90 BRAF (0.52) FLT3BRAFRETNTRK1NTRK3
SCHEMBL20878949 0.89 RET (0.51) FLT3BRAFRETNTRK1NTRK3
SCHEMBL19683762 0.88 RET (0.45) FLT3MEN1NPC1RAB9AKMT2A
SCHEMBL20878925 0.88 RET (0.50) FLT3BRAFRETNTRK1NTRK3
SCHEMBL23047344 0.85 RET (0.53) FLT3BRAFRETNTRK1NTRK3

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