SCHEMBL6912951

SCHEMBL6912951

CCC1=C(C(C)C2=C(CC)[CH]c3ccccc32)c2ccccc2[CH]1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CDC25A P30304 1/20 0.31
CDC25B P30305 1/20 0.31
SETD7 Q8WTS6 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
SCHEMBL7033348 0.80 TDP1 (0.32)
SCHEMBL5597075 0.74 CDC25A (0.35) LMNACDC25ACDC25B
SCHEMBL7005323 0.74 CDC25B (0.37) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL2863610 0.74 FGFR1 (0.34) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL218144 0.74 MAP2K7 (0.33) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL28025480 0.69 TP53 (0.38) ALDH1A1LMNAMAPTCDC25ACDC25B
SCHEMBL6240155 0.69 SETD7 (0.30) SETD7
SCHEMBL3899597 0.65 CDC25A (0.37) ALDH1A1LMNAMAPTCDC25ACDC25B
SCHEMBL5688926 0.65 CDC25B (0.43) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL7269663 0.65 TDP1 (0.37) ALDH1A1LMNAL3MBTL1SETD7

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-0832924-B1 Polyolefin composition for the preparation of non-wovens BASELL POLYOLEFINE GMBH (DE) 2004-10-13 EP disclosed