SCHEMBL8906196

SCHEMBL8906196

CNc1cc(C)[nH]c(=O)n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
NOS3 P29474 1/20 0.42
NOS2 P35228 1/20 0.42
PKM P14618 3/20 0.39
LMNA P02545 2/20 0.39
KMT2A Q03164 1/20 0.39
MAT2A P31153 1/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PSMD14 O00487 1/20 0.36
MMP2 P08253 1/20 0.36
CA1 P00915 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL18358503 0.82 MAPT (0.48) MAPTPKMLMNAKMT2AADORA2A
SCHEMBL17327810 0.79 MAT2A (0.40) MAPTNOS3NOS2MAT2A
SCHEMBL3793924 0.78 NOS3 (0.36) MAPTNOS3NOS2MAT2A
SCHEMBL2463447 0.76 KMT2A (0.47) MAPTPKMLMNAKMT2AADORA2A
SCHEMBL1178128 0.73
Water SCHEMBL11262034 0.71 MAPT (0.55) MAPTPKMLMNAKMT2ANPC1
Hydrochloric Acid SCHEMBL1644792 0.71 MAPT (0.55) MAPTPKMLMNAKMT2ANPC1
SCHEMBL10402501 0.70
SCHEMBL1934832 0.70
SCHEMBL24729665 0.67 MAPT (0.50) MAPTNOS3NOS2PKMLMNA

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-5698685-A Morpholino-subunit combinatorial library and method ANTIVIRALS INC. (US) 1997-12-16 US disclosed
US-5506337-A Morpholino-subunit combinatorial library and method ANTIVIRALS INC. (US) 1996-04-09 US disclosed