SCHEMBL8920313

SCHEMBL8920313

Cc1ccc2c(c1)C(=N)NC21OC(C)O1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8922236 0.88
SCHEMBL8918851 0.83 PPOX (0.32)
SCHEMBL8918904 0.81 ACHE (0.36) ACHEKDM4EALDH1A1MAPTHSD17B10
SCHEMBL8920309 0.79 PARP1 (0.35) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL7816525 0.79 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL8918880 0.77 TDP1 (0.40) ALDH1A1
SCHEMBL8921050 0.76 MAOB (0.40) ACHEMAPT
SCHEMBL8919249 0.76 MEN1 (0.36) ALDH1A1MAPT
SCHEMBL8920374 0.76 KMT2A (0.36) KDM4EALDH1A1MAPT
SCHEMBL8921444 0.73 PDK2 (0.38) KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691272-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-11-25 US disclosed
US-5559247-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-24 US disclosed
EP-0679640-A1 Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-11-02 EP disclosed