SCHEMBL6958019

SCHEMBL6958019

C/C=C/COc1ccc2c(c1)CCN(c1nc(Nc3ccc(F)cc3)nc(C)c1C)C2C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 3/20 0.33
MAPT P10636 4/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FGFR1 P11362 2/20 0.32
FGFR2 P21802 2/20 0.32
FGFR4 P22455 2/20 0.32
FGFR3 P22607 2/20 0.32
MEN1 O00255 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
EGFR P00533 1/20 0.32
FYN P06241 1/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
PRKACA P17612 1/20 0.32
PRKACG P22612 1/20 0.32
PRKACB P22694 1/20 0.32
MAPK1 P28482 1/20 0.32
KDR P35968 1/20 0.32
EPHB3 P54753 1/20 0.32

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
SCHEMBL6969913 0.94 MAPT (0.32) FKBP1AMAPTNPSR1FGFR1FGFR2
Hydrochloric Acid SCHEMBL6964992 0.86 CA1 (0.40) FKBP1AMAPTNPSR1FGFR1FGFR2
SCHEMBL6958026 0.85 KMT2A (0.35) FKBP1AMAPTNPSR1FGFR1FGFR2
SCHEMBL6958023 0.85 KMT2A (0.35) FKBP1AMAPTNPSR1FGFR1FGFR2
SCHEMBL6158156 0.84 KMT2A (0.40) MAPTMEN1BLMKMT2AMAPK1
Hydrochloric Acid SCHEMBL6157511 0.83 KMT2A (0.39) MAPTMEN1BLMKMT2AMAPK1
SCHEMBL6964822 0.83 BRD4 (0.39) MAPTKMT2APPARAPPARGTP53
SCHEMBL6965486 0.83 KMT2A (0.37) MAPTNPSR1FGFR1FGFR2FGFR4
SCHEMBL6956604 0.82 KMT2A (0.35) MAPTNPSR1FGFR1FGFR2FGFR4
SCHEMBL6962244 0.81 KMT2A (0.35) MAPTNPSR1FGFR1FGFR2FGFR4

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-1015444-B1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP LTD (KR) 2003-05-28 EP disclosed
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US disclosed