SCHEMBL19683628

SCHEMBL19683628

CCN1CCN(c2ccc(C(=N)c3c(N)ncnc3Nc3ccc(Nc4cc(C(C)(C)C)on4)cc3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.43
EGFR P00533 1/20 0.40
RET P07949 7/20 0.40
FLT3 P36888 5/20 0.38
CSF1R P07333 1/20 0.38
KDR P35968 2/20 0.37
AURKA O14965 1/20 0.37
JAK2 O60674 1/20 0.37
ABL1 P00519 1/20 0.37
INSR P06213 1/20 0.37
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
YES1 P07947 1/20 0.37
LYN P07948 1/20 0.37
MET P08581 1/20 0.37
ROS1 P08922 1/20 0.37
KIT P10721 1/20 0.37
BCR P11274 1/20 0.37
FGFR1 P11362 1/20 0.37
SRC P12931 1/20 0.37

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
SCHEMBL19683644 0.92 FLT3 (0.41) BRAFEGFRRETFLT3CSF1R
SCHEMBL20878996 0.92 RET (0.41) BRAFEGFRRETFLT3CSF1R
SCHEMBL20878953 0.88 FLT3 (0.50) BRAFEGFRRETFLT3CSF1R
SCHEMBL20878898 0.85 RET (0.52) BRAFRETFLT3CSF1RKDR
SCHEMBL19683701 0.83 FLT3 (0.44) BRAFEGFRRETFLT3CSF1R
SCHEMBL20878980 0.83 FLT3 (0.53) BRAFRETFLT3CSF1RKDR
SCHEMBL23047310 0.82 RET (0.41) BRAFRETFLT3CSF1RKDR
SCHEMBL19683697 0.82 RET (0.44) BRAFRETFLT3CSF1RKDR
SCHEMBL19683754 0.82 RET (0.52) BRAFRETFLT3CSF1RKDR
SCHEMBL23047345 0.82 RET (0.46) BRAFRETFLT3CSF1RKDR

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-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