SCHEMBL7654953

SCHEMBL7654953

CCN(CC)c1ccc(NC(=O)C(C)c2ccncc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 2/20 0.50
LMNA P02545 2/20 0.50
GFER P55789 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CNR2 P34972 1/20 0.49
RAB9A P51151 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NOX1 Q9Y5S8 2/20 0.49
NPC1 O15118 2/20 0.49
GAA P10253 2/20 0.47
POLB P06746 1/20 0.47
MCL1 Q07820 1/20 0.47
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
FFAR2 O15552 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46

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
SCHEMBL7651646 0.85 HTT (0.67) MAPTSMN1; SMN2HTTLMNAGFER
SCHEMBL1594108 0.83 SMN1; SMN2 (0.56) MAPTSMN1; SMN2HTTLMNAGFER
SCHEMBL7652098 0.81 MAPT (0.52) MAPTSMN1; SMN2HTTLMNAGFER
SCHEMBL2183465 0.79 PSEN1 (0.72) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14226463 0.76 LMNA (0.64) MAPTSMN1; SMN2HTTLMNARAB9A
SCHEMBL3156221 0.74 MAPT (0.74) MAPTSMN1; SMN2LMNANPSR1RAB9A
SCHEMBL7651061 0.74 RAB9A (0.60) MAPTSMN1; SMN2HTTGFERNPSR1
SCHEMBL1821157 0.74 MAPT (0.74) MAPTSMN1; SMN2LMNANPSR1RAB9A
SCHEMBL1817848 0.73 MEN1 (0.58) MAPTSMN1; SMN2HTTMEN1KMT2A
SCHEMBL14226462 0.73 TSHR (0.57) MAPTSMN1; SMN2LMNARAB9AMEN1

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-6407120-B1 ADMINISTERING PYRIDINYLACETAMIDE OR PHENYLACETAMIDE DERIVATIVE TO TREAT CARDIOVASCULAR, EATING, SEXUAL, BRAIN, NERVOUS SYSTEM, GASTROINTESTINAL, UROGENITAL, PSYCHOLOGICAL, AND RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2002-06-18 US disclosed