SCHEMBL7752643

SCHEMBL7752643

CCCCCCC(F)COc1ccc(-c2ncc(CCCCCCCCC3CCCC3)cn2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.38
RAB9A P51151 3/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
S1PR5 Q9H228 1/20 0.33
PPARG P37231 3/20 0.33
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 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
SCHEMBL7752639 1.00 RARB (0.38) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL8024694 0.90 RARB (0.46) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7751458 0.90 S1PR4 (0.37) RAB9ASMN1; SMN2KDM4EHSD17B10TDP1
SCHEMBL7751463 0.90 S1PR4 (0.37) RAB9ASMN1; SMN2KDM4EHSD17B10TDP1
SCHEMBL7751437 0.88 RARB (0.42) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7750464 0.88 RARB (0.42) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7749998 0.88 RARB (0.42) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7751441 0.86 RARB (0.43) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7751372 0.86 RARB (0.43) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7751365 0.86 RARB (0.43) RARBRAB9AMAPTSMN1; SMN2KDM4E

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-0821049-B1 Cyclopentyl compounds ROLIC AG (CH) 2001-01-10 EP disclosed
EP-0821049-A1 Cyclopentyl compounds Rolic AG (CH) 1998-01-28 EP disclosed