SCHEMBL8419090

SCHEMBL8419090

CNc1cc(-n2cnc3cccc(C(=O)OC)c32)ccc1-c1ccccc1-c1nnn[nH]1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 5/20 0.36
SRC P12931 1/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
DYRK1A Q13627 1/20 0.35
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
ATM Q13315 1/20 0.34
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
GFER P55789 1/20 0.32
DHODH Q02127 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GRM5 P41594 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
SCHEMBL8417944 0.91 FGFR1 (0.35) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8417985 0.90 FGFR1 (0.34) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8635495 0.89 FGFR1 (0.42) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8421430 0.88 RIPK1 (0.37) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8419222 0.87 FGFR1 (0.36) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8421706 0.87 FGFR1 (0.37) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8422153 0.86 FGFR1 (0.35) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8419025 0.86 FGFR1 (0.36) FGFR1SRCDYRK1AMEN1KMT2A
SCHEMBL8519657 0.85 FGFR1 (0.34) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8418025 0.85 FGFR1 (0.34) FGFR1SRCESR1ESR2DYRK1A

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
US-5962491-A ANGIOTENSIN ANTAGONIST, HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS, STROKES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-05 US disclosed
US-5705517-A ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-01-06 US disclosed
US-5703110-A HYPOTENSIVE AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-30 US disclosed