SCHEMBL9537596

SCHEMBL9537596

Cc1cccc(-c2ccccc2)c1NC(=N)N(C)C.Cc1cccc(NC(=N)N(C)C)c1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 3/20 0.41
ALDH1A1 P00352 6/20 0.38
MAPT P10636 2/20 0.35
KDM4E B2RXH2 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.34
LMNA P02545 4/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PARP14 Q460N5 1/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR4 P22455 1/20 0.33
FGFR3 P22607 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
PLA2G1B P04054 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
SCHEMBL9059754 0.89 FABP4 (0.49) FABP4ALDH1A1MAPTKDM4ERAB9A
SCHEMBL9059999 0.89 SMN1; SMN2 (0.39) ALDH1A1MAPTKDM4ERAB9ASMN1; SMN2
SCHEMBL9311252 0.78 FABP4 (0.49) FABP4ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL9059577 0.73 ALDH1A1 (0.45) FABP4ALDH1A1LMNAL3MBTL1MEN1
SCHEMBL9539853 0.72 HTR7 (0.38) FABP4ALDH1A1MAPTKDM4ERAB9A
SCHEMBL9059653 0.71 ALDH1A1 (0.49) FABP4ALDH1A1MAPTKDM4ERAB9A
Fumaric Acid SCHEMBL9311944 0.69 ALDH1A1 (0.64) FABP4ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL9311982 0.69 ALDH1A1 (0.44) ALDH1A1MAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL366745 0.69 FABP4 (0.62) FABP4ALDH1A1MAPTKDM4ERAB9A
SCHEMBL27534803 0.69 FABP4 (0.62) FABP4ALDH1A1MAPTKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536151-A1 ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM. BOOTS CO PLC (GB) 1993-04-14 EP disclosed