SCHEMBL9305072

SCHEMBL9305072

NCCn1nc(-c2ccccc2F)c2cnccc21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
MAOA P21397 4/20 0.37
MAOB P27338 4/20 0.37
DHODH Q02127 2/20 0.37
ACHE P22303 1/20 0.37
MERTK Q12866 1/20 0.36
TDP1 Q9NUW8 4/20 0.36
PIM1 P11309 4/20 0.35
F10 P00742 1/20 0.34
F7 P08709 1/20 0.34
F3 P13726 1/20 0.34
ADORA2A P29274 2/20 0.34

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
SCHEMBL9305829 0.92 TDP1 (0.41) CSNK2A2CSNK2BMAOAMAOBDHODH
SCHEMBL8138791 0.86 CSNK2A2 (0.39) CSNK2A2CSNK2BMAOAMAOBACHE
SCHEMBL9305230 0.86 MAOA (0.36) MAOAMAOBACHETDP1
SCHEMBL8134219 0.86 CDC7 (0.41) MAOAMAOBACHEMERTKTDP1
Hydrochloric Acid SCHEMBL8138778 0.85 TDP1 (0.36) MAOAMAOBACHETDP1
SCHEMBL9306122 0.83 HSD17B10 (0.47) MAOAMAOBACHEMERTK
SCHEMBL9305086 0.83 AXL (0.39) MERTKTDP1ADORA2A
Hydrochloric Acid SCHEMBL8134231 0.82 HSD17B10 (0.46) MAOAMAOBACHEMERTK
SCHEMBL9304005 0.81 P2RX7 (0.38) MAOA
SCHEMBL9258008 0.80 NAMPT (0.39) MAOAMAOBACHEMERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5296491-A Pyrazolo[4,3-c]pyridines and their use as serotonin reuptake inhibitors HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-03-22 US claimed