SCHEMBL861554

SCHEMBL861554

CCC1(c2c[nH]c(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)C(=O)c2ccccc2C1=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.33
PKM P14618 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
APEX1 P27695 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
LMNA P02545 1/20 0.31
SLC6A9 P48067 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL856677 0.67 LMNA (0.39) GAAMAPTRAB9ASMN1; SMN2KMT2A
SCHEMBL5738210 0.67 ADORA2A (0.32)
SCHEMBL14592445 0.66 MAPT (0.66) GAAMAPTRAB9ASMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL856678 0.66 LMNA (0.38) GAAMAPTRAB9ASMN1; SMN2KMT2A
SCHEMBL855359 0.66 GAA (0.38) GAAMAPTRAB9ASMN1; SMN2KMT2A
SCHEMBL6956027 0.65 HSD17B10 (0.48) GAAMAPTRAB9ASMN1; SMN2KMT2A
SCHEMBL10896790 0.65 L3MBTL1 (0.39) GAAMAPTRAB9ASMN1; SMN2KMT2A
SCHEMBL6821893 0.64 ALDH1A1 (0.37) MAPTSMN1; SMN2KMT2ACYP1A2CYP2D6
SCHEMBL3827052 0.64 KCNN4 (0.33) GAAMAPTKMT2ATSHR
SCHEMBL5240366 0.64 KCNN4 (0.31)

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-2225209-B1 PROCESS FOR THE PREPARATION OF 5-(2-ETHYL-DIHYDRO-1H-INDEN-2-YL)-1H-IMIDAZOLE AND SALTS THEREOF GRINDEKS JSC (LV) 2012-03-28 EP claimed