SCHEMBL9878096

SCHEMBL9878096

CCc1nn(CC(=O)O)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.57
PTGDR2 Q9Y5Y4 1/20 0.45
PTGIR P43119 1/20 0.45
HSD17B10 Q99714 1/20 0.44
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
PTGS2 P35354 1/20 0.42
ADORA2A P29274 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.39
CMA1 P23946 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL10553872 0.93 ALOX15 (0.51) ALOX15PTGDR2PTGIRHSD17B10MAPT
SCHEMBL10445943 0.92 ALOX15 (0.50) ALOX15PTGDR2PTGIRHSD17B10MAPT
SCHEMBL10419697 0.90 ALOX15 (0.48) ALOX15PTGDR2PTGS2SMN1; SMN2MEN1
SCHEMBL10414085 0.87 ALOX15 (0.50) ALOX15PTGDR2PTGIRHSD17B10MAPT
SCHEMBL2375145 0.74 PTGIR (0.57) PTGIR
SCHEMBL2375142 0.74 PTGIR (0.57) PTGIR
SCHEMBL12243499 0.74 PTGIR (0.57) PTGIR
SCHEMBL24076967 0.73 ALOX15 (1.00) ALOX15MAPTTSHRRAB9ACMA1
SCHEMBL23399319 0.72 DHFR (0.45) ALOX15MAPTPTGS2ADORA2ASMN1; SMN2
SCHEMBL23401417 0.70 HTR2A (0.47) ALOX15HSD17B10MAPTADORA2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0299407-B1 1H-PYRAZOLE-1-ALKANAMIDES AND PREPARATION USEFUL AS ANTIARRHYTHMIC AGENTS STERLING DRUG INC. (US) 1990-10-24 EP claimed
US-4988725-A Cardiovascular disorders, antiarrhythmia agents STERLING DRUG INC. (US) 1991-01-29 US disclosed
EP-0388654-A2 Azole-1-alkanamides as antiarrhythmic agents and preparation thereof STERLING DRUG INC. (US) 1990-09-26 EP disclosed
US-4916150-A 1H-pyrazole-1-alkanamines antiarrhythmic compositions and use STERLING DRUG INC. (US) 1990-04-10 US disclosed
US-4870095-A 1H-pyrazole-1-alkanamides, antiarrhythmic compositions and use STERLING DRUG, INC. (US) 1989-09-26 US disclosed