SCHEMBL9801193

SCHEMBL9801193

CCC1CN(CCO)CCN1C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SIGMAR1 Q99720 5/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
PKM P14618 1/20 0.31

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
SCHEMBL9801642 0.89 SIGMAR1 (0.40) ALDH1A1SIGMAR1KMT2AMEN1L3MBTL1
SCHEMBL14438561 0.86 MAPK1 (0.40) MAPK1ALDH1A1KDM4ESIGMAR1KMT2A
SCHEMBL3428847 0.86 MAPK1 (0.40) MAPK1ALDH1A1KDM4ESIGMAR1KMT2A
SCHEMBL3429440 0.86 MAPK1 (0.40) MAPK1ALDH1A1KDM4ESIGMAR1KMT2A
SCHEMBL9801140 0.83 DRD3 (0.36) SIGMAR1
SCHEMBL9559582 0.82 SIGMAR1 (0.40) MAPK1ALDH1A1KDM4ESIGMAR1L3MBTL1
SCHEMBL21567209 0.81 KDM4E (0.32) ALDH1A1KDM4ESIGMAR1
SCHEMBL9801964 0.81 SIGMAR1 (0.40) MAPK1ALDH1A1KDM4ESIGMAR1KMT2A
SCHEMBL9801382 0.80 ALOX15 (0.46) SIGMAR1
SCHEMBL9801272 0.79 SIGMAR1 (0.42) MAPK1ALDH1A1SIGMAR1L3MBTL1LMNA

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
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed