SCHEMBL8424296

SCHEMBL8424296

CC(C)(C)P(CCC=Nc1ccccc1)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GLA P06280 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KMT2A Q03164 2/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
RAB9A P51151 1/20 0.31
MAOA P21397 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
SCHEMBL8420820 0.81 ALDH1A1 (0.33) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL8419195 0.74 KMT2A (0.33) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL637260 0.72 KDM4E (0.38) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL637259 0.72 KDM4E (0.38) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL17916180 0.71 ALDH1A1 (0.36) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL11292213 0.69 ALDH1A1 (0.37) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL10090559 0.69 ALDH1A1 (0.45) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL7516473 0.69 ALDH1A1 (0.45) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL6536579 0.69 SIRT2 (0.38) KDM4EALDH1A1GLAL3MBTL1KMT2A
SCHEMBL6301209 0.69 KMT2A (0.36) KDM4EALDH1A1GLAL3MBTL1KMT2A

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-0944638-A1 CIS-BRIDGED METAL COMPLEXES BASF AKTIENGESELLSCHAFT (DE) 1999-09-29 EP disclosed
WO-1998025939-A1 CIS-BRIDGED METAL COMPLEXES BASF AKTIENGESELLSCHAFT (DE) 1998-06-18 WO disclosed