SCHEMBL7119341

SCHEMBL7119341

CCOC(=O)C1CCN(N2CCOCC2)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
ALDH1A1 P00352 6/20 0.53
LGMN Q99538 1/20 0.52
TSHR P16473 3/20 0.50
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
NPC1 O15118 1/20 0.47
RECQL P46063 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL18039877 0.85 MAPT (0.54) MAPTALDH1A1LGMNTSHRLMNA
SCHEMBL72855 0.82 MAPT (0.51) MAPTALDH1A1LGMNTSHRCYP3A4
SCHEMBL6521670 0.81 ALDH1A1 (0.65) MAPTALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL18040053 0.81 MAPT (0.53) MAPTALDH1A1LGMNCYP3A4CYP2D6
SCHEMBL464391 0.80 ALDH1A1 (0.73) MAPTALDH1A1TSHRCYP3A4CYP2D6
SCHEMBL18039931 0.79 ALDH1A1 (0.57) MAPTALDH1A1TSHRPOLBLMNA
SCHEMBL15569388 0.79 MAPT (0.62) MAPTALDH1A1LMNAKDM4ESMN1; SMN2
SCHEMBL8211769 0.77 TSHR (0.71) ALDH1A1TSHRCYP3A4CYP2C19POLB
SCHEMBL446501 0.77 MAPT (0.64) MAPTALDH1A1CYP3A4CYP2D6CYP2C9
SCHEMBL21480659 0.77 MAPT (0.64) MAPTALDH1A1TSHRCYP3A4CYP2D6

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
JP-2003040892-A RUTHENIUM PHTHALOCYANIN DERIVATIVE AND METHOD OF PRODUCING THE SAME AISIN SEIKI CO LTD 2003-02-13 JP disclosed