SCHEMBL25914667

SCHEMBL25914667

CC(=O)Nc1cc(Oc2ccc3nc(-c4cnc(NCCF)n(C)c4=O)ccc3c2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 11/20 0.44
▸ PDGFRB P09619 4/20 0.42
▸ LCK P06239 2/20 0.42
▸ KIT P10721 2/20 0.42
▸ FYN P06241 1/20 0.42
▸ SRC P12931 1/20 0.42
▸ FLT1 P17948 1/20 0.42
▸ FLT4 P35916 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ P2RX3 P56373 3/20 0.41
▸ CSF1R P07333 3/20 0.41
▸ PDGFRA P16234 2/20 0.41
▸ MAPK14 Q16539 3/20 0.38
▸ MAPK13 O15264 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ PTK6 Q13882 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
SCHEMBL25910289 0.92 BRAF (0.49) BRAFPDGFRBLCKKITFYN
SCHEMBL25910424 0.90 BRAF (0.47) BRAFPDGFRBLCKKITFYN
SCHEMBL25910564 0.88 BRAF (0.46) BRAFPDGFRBLCKKITFYN
SCHEMBL25909917 0.87 PDGFRB (0.52) BRAFPDGFRBLCKKITFYN
SCHEMBL25914665 0.86 CSF1R (0.39) BRAFPDGFRBLCKKITKDR
SCHEMBL25910567 0.85 BRAF (0.42) BRAFPDGFRBLCKKITFYN
SCHEMBL25910556 0.85 PDGFRB (0.49) BRAFPDGFRBLCKKITFYN
SCHEMBL25912842 0.85 PDGFRB (0.52) BRAFPDGFRBLCKKITFYN
SCHEMBL25910799 0.84 BRAF (0.46) BRAFPDGFRBLCKKITFYN
SCHEMBL25910809 0.84 BRAF (0.45) BRAFPDGFRBLCKKITFYN

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
WO-2023125812-A1 SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2023-07-06 — — WO disclosed
Send feedback