SCHEMBL4393593

SCHEMBL4393593

CCN(CC)CCOC(=O)C1c2ccccc2Oc2ccccc21

nearest known ligand 0.97

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.97
MEN1 O00255 5/20 0.97
CYP1A2 P05177 4/20 0.63
LMNA P02545 4/20 0.63
CYP2D6 P10635 3/20 0.63
CHRM2 P08172 2/20 0.63
CHRM1 P11229 2/20 0.63
KCNH2 Q12809 2/20 0.63
ALDH1A1 P00352 3/20 0.58
TSHR P16473 2/20 0.58
CYP3A4 P08684 2/20 0.58
ALOX15 P16050 1/20 0.58
NFKB1 P19838 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
MAPT P10636 2/20 0.57
USP2 O75604 1/20 0.57
APEX1 P27695 1/20 0.57
RECQL P46063 1/20 0.57
PMP22 Q01453 1/20 0.57
TDP1 Q9NUW8 1/20 0.57

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
SCHEMBL30494683 1.00 KMT2A (0.97) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL17562151 0.84 KMT2A (0.71) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL2736397 0.84 ATM (0.71) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL27370526 0.83 KMT2A (0.69) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL595243 0.82 ATM (0.69) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL10517659 0.81 KMT2A (0.66) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL2998582 0.80 KMT2A (0.65) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL21675546 0.80 KMT2A (0.64) KMT2AMEN1CYP1A2LMNACYP2D6
Iodomethane SCHEMBL11714808 0.79 KMT2A (0.64) KMT2AMEN1CYP1A2LMNACYP2D6
SCHEMBL26376555 0.79 KMT2A (0.63) KMT2AMEN1CYP1A2LMNACYP2D6

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
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed