SCHEMBL8991872

SCHEMBL8991872

O=Cc1cnc(N=NNc2ccccc2)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
CYP1A1 P04798 1/20 0.42
TSHR P16473 1/20 0.42
CYP1B1 Q16678 1/20 0.42
ALDH1A1 P00352 8/20 0.40
MAPT P10636 6/20 0.40
KDM4E B2RXH2 1/20 0.39
RAB9A P51151 7/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
NPC1 O15118 5/20 0.37
CASP3 P42574 3/20 0.37
SENP7 Q9BQF6 3/20 0.37
SENP8 Q96LD8 2/20 0.37
SENP6 Q9GZR1 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 2/20 0.35
LMNA P02545 2/20 0.33
PSMD14 O00487 1/20 0.33

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
SCHEMBL8923185 0.86 MAPT (0.33) TDP1ALDH1A1MAPTKDM4ERAB9A
SCHEMBL8991877 0.74 ALDH1A1 (0.46) TDP1CYP1A1TSHRCYP1B1ALDH1A1
SCHEMBL8743004 0.71 MEN1 (0.56) TDP1CYP1A1TSHRCYP1B1ALDH1A1
SCHEMBL8991869 0.71 NPC1 (0.47) TDP1ALDH1A1MAPTKDM4ERAB9A
SCHEMBL8743296 0.67 TDP1 (0.48) TDP1CYP1A1TSHRCYP1B1ALDH1A1
SCHEMBL11485493 0.67
SCHEMBL11485490 0.67
SCHEMBL8767775 0.65 NPC1 (0.54) TDP1CYP1A1TSHRCYP1B1MAPT
SCHEMBL9394 0.64 ALDH1A1 (0.50) ALDH1A1MAPTKDM4ERAB9AMEN1
SCHEMBL1657374 0.63 GRM5 (0.50) ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5308825-A Thermal dye transfer printing AGFA-GEVAERT, N.V. (BE) 1994-05-03 US claimed
US-5510225-A CONTAINS ANILINE AZO DYE IN A DYE LAYER CARRIED BY POLYMERIC BINDER RESIN ON A SUPPORT AGFA-GEVAERT, N.V. (BE) 1996-04-23 US disclosed
US-5308825-A Thermal dye transfer printing AGFA-GEVAERT, N.V. (BE) 1994-05-03 US disclosed
EP-0522207-A1 Thermal dye transfer printing method and dye-donor element for use according to said method AGFA-GEVAERT N.V. (BE) 1993-01-13 EP disclosed