SCHEMBL5961419

SCHEMBL5961419

Cc1ccc(NC(=N)N(N)c2ccc(C)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 2/20 0.46
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KIF11 P52732 1/20 0.42
POLB P06746 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
NPC1 O15118 2/20 0.40
DDAH1 O94760 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL9116925 0.85 RAB9A (0.46) ALDH1A1TDP1KDM4ERAB9ASMN1; SMN2
SCHEMBL10336593 0.79 RAB9A (0.46) ALDH1A1TDP1KDM4ERAB9ASMN1; SMN2
SCHEMBL5961424 0.77 ALDH1A1 (0.42) ALDH1A1TDP1RAB9ASMN1; SMN2GRIN2D
SCHEMBL10336591 0.76 NPC1 (0.47) ALDH1A1TDP1RAB9ASMN1; SMN2POLB
SCHEMBL6299756 0.76 POLB (0.44) ALDH1A1TDP1KDM4ERAB9ASMN1; SMN2
SCHEMBL10797488 0.75 HPGD (0.45) ALDH1A1TDP1RAB9ASMN1; SMN2NPC1
SCHEMBL6298803 0.75 ALDH1A1 (0.41) ALDH1A1TDP1KDM4ERAB9ASMN1; SMN2
SCHEMBL6298600 0.74 POLB (0.42) ALDH1A1TDP1KDM4ERAB9ASMN1; SMN2
SCHEMBL6298817 0.72 ALDH1A1 (0.38) ALDH1A1TDP1KDM4ERAB9ASMN1; SMN2
SCHEMBL166139 0.71 KIF11 (0.55) TDP1KDM4ERAB9AKIF11POLB

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
EP-1353986-B1 COLORED THERMOPLASTIC RESIN COMPOSITIONS FOR LASER WELDING, ANTHRAQUINONE COLORANTS THEREFOR AND MOLDED PRODUCT THEREFROM DU PONT (US) 2006-04-12 EP claimed
EP-1334148-B1 COLORED THERMOPLASTIC RESIN COMPOSITIONS FOR LASER WELDING, COLORANTS THEREFOR OF MIXTURES OF AMINE SALTS OF ANTHRAQUINONE AND MONOAZO COMPLEX DYES, AND MOLDED PRODUCT THEREFROM DU PONT (US) 2006-03-15 EP claimed
EP-1353986-B1 COLORED THERMOPLASTIC RESIN COMPOSITIONS FOR LASER WELDING, ANTHRAQUINONE COLORANTS THEREFOR AND MOLDED PRODUCT THEREFROM DU PONT (US) 2006-04-12 EP disclosed
EP-1334148-B1 COLORED THERMOPLASTIC RESIN COMPOSITIONS FOR LASER WELDING, COLORANTS THEREFOR OF MIXTURES OF AMINE SALTS OF ANTHRAQUINONE AND MONOAZO COMPLEX DYES, AND MOLDED PRODUCT THEREFROM DU PONT (US) 2006-03-15 EP disclosed