SCHEMBL8417985

SCHEMBL8417985

CCCNc1cc(-n2cnc3cccc(C(=O)OC)c32)ccc1-c1ccccc1-c1nnn[nH]1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.34
SRC P12931 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
DYRK1A Q13627 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RIPK1 Q13546 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL8421430 0.95 RIPK1 (0.37) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8417944 0.94 FGFR1 (0.35) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8419090 0.90 FGFR1 (0.36) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8421146 0.88 GABRG2 (0.34) MEN1KMT2AALDH1A1
SCHEMBL8419025 0.87 FGFR1 (0.36) FGFR1SRCDYRK1AMEN1KMT2A
SCHEMBL8421706 0.87 FGFR1 (0.37) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8419430 0.86 TSHR (0.37) MEN1KMT2A
SCHEMBL8635495 0.85 FGFR1 (0.42) FGFR1SRCESR1ESR2DYRK1A
SCHEMBL8421731 0.85 FGFR1 (0.33) FGFR1SRCDYRK1AMEN1KMT2A
SCHEMBL8519657 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 2 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