SCHEMBL9199717

SCHEMBL9199717

CCC1CCCCN1C(=O)C=CC=Cc1c(-c2ccccc2)nn2ccccc12

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.72
ADORA2B P29275 2/20 0.72
ADORA3 P0DMS8 1/20 0.72
ADORA1 P30542 1/20 0.72
L3MBTL1 Q9Y468 2/20 0.48
LMNA P02545 1/20 0.48
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
DAGLA Q9Y4D2 3/20 0.44
HRH3 Q9Y5N1 1/20 0.43
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.40
ABHD11 Q8NFV4 1/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
PTGS2 P35354 1/20 0.39
HPGD P15428 1/20 0.39
EGFR P00533 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL9199705 1.00 ADORA2A (0.72) ADORA2AADORA2BADORA3ADORA1L3MBTL1
SCHEMBL9199652 0.94 ADORA2A (0.81) ADORA2AADORA2BADORA3ADORA1L3MBTL1
SCHEMBL9199146 0.94 ADORA2A (0.81) ADORA2AADORA2BADORA3ADORA1L3MBTL1
SCHEMBL9199656 0.94 ADORA2A (0.81) ADORA2AADORA2BADORA3ADORA1L3MBTL1
SCHEMBL9193576 0.94 ADORA2A (0.81) ADORA2AADORA2BADORA3ADORA1L3MBTL1
SCHEMBL9193574 0.94 ADORA2A (0.81) ADORA2AADORA2BADORA3ADORA1L3MBTL1
SCHEMBL9199141 0.94 ADORA2A (0.81) ADORA2AADORA2BADORA3ADORA1L3MBTL1
Bromide SCHEMBL9196080 0.93 ADORA2A (0.80) ADORA2AADORA2BADORA3ADORA1L3MBTL1
Bromide SCHEMBL9196084 0.93 ADORA2A (0.80) ADORA2AADORA2BADORA3ADORA1L3MBTL1
Bromide SCHEMBL9195435 0.93 ADORA2A (0.80) ADORA2AADORA2BADORA3ADORA1L3MBTL1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0299209-B1 Pyrazolopyridine compound and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-09-13 EP disclosed
US-5296490-A Pharmaceutically useful pyrazolopyridines FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-22 US disclosed
US-5179103-A Diuretics, hypotensive agents FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1993-01-12 US disclosed
US-5102878-A Treating psychological, bone, cardiovascular, blood disorders FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-07 US disclosed
US-5102869-A Urogenital disorders FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-07 US disclosed
US-5087629-A Diuretics, hypotensive agents; cardiotonic agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-02-11 US disclosed
US-4994453-A Treating asthma, diabetes, obesity, immunosuppression FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-19 US disclosed
US-4925849-A DIURETICS, HYPOTENSIVE AGENTS, CARIOTONIC AGENTS AND ANTIEDEMIC AGENTS FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-05-15 US disclosed
EP-0299209-A2 Pyrazolopyridine compound and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-18 EP disclosed