SCHEMBL10767950

SCHEMBL10767950

Cc1nnc2ccc(-c3cccc(NC(N)=O)c3)nn12

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.69
SMN1; SMN2 Q16637 7/20 0.69
KDM4E B2RXH2 4/20 0.66
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
ALDH1A1 P00352 2/20 0.65
POLB P06746 1/20 0.65
RECQL P46063 1/20 0.65
BRD4 O60885 1/20 0.58
LIN28A Q9H9Z2 1/20 0.58
LMNA P02545 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
GABRA1 P14867 1/20 0.55
HPGD P15428 1/20 0.55
GABRG2 P18507 1/20 0.55
GABRB3 P28472 1/20 0.55
GABRA5 P31644 1/20 0.55
GABRA3 P34903 1/20 0.55

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
SCHEMBL10389277 0.90 SMN1; SMN2 (0.71) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL3476408 0.89 SMN1; SMN2 (0.73) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10694000 0.86 SMN1; SMN2 (0.66) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10389328 0.86 SMN1; SMN2 (0.66) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL3476495 0.86 MEN1 (0.71) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10766916 0.85 KDM4E (0.79) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10389605 0.84 MEN1 (0.69) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10389884 0.84 SMN1; SMN2 (0.64) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10695238 0.83 MAPT (0.63) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10389949 0.82 SMN1; SMN2 (0.62) MAPTSMN1; SMN2KDM4EMEN1KMT2A

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
EP-0223974-A1 N-Substituted-N-[3-(1,2,4-triazolo[4,3-b]pyridazin-6-yl)-phenyl]alkanamides, carbamates and ureas AMERICAN CYANAMID COMPANY (US) 1987-06-03 EP disclosed
EP-0215650-A2 Substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1987-03-25 EP disclosed