SCHEMBL9013941

SCHEMBL9013941

CCN(CCC(=O)Oc1ccccc1OC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 4/20 0.44
POLB P06746 4/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RECQL P46063 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TSHR P16473 2/20 0.40
MCL1 Q07820 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL11212465 0.82 TDP1 (0.45) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL7038319 0.82 MEN1 (0.49) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL11670888 0.81 ALDH1A1 (0.42) KMT2AMEN1MAPTALDH1A1POLB
SCHEMBL3361882 0.78 KMT2A (0.59) KMT2AMEN1MAPTALDH1A1POLB
SCHEMBL8035941 0.78 SMN1; SMN2 (0.63) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL1792324 0.77 L3MBTL1 (0.56) KMT2AMEN1MAPTALDH1A1POLB
SCHEMBL31053826 0.77 L3MBTL1 (0.56) KMT2AMEN1MAPTALDH1A1POLB
SCHEMBL3868884 0.76 MEN1 (0.47) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL3361878 0.76 LMNA (0.62) KMT2AMEN1MAPTALDH1A1POLB
SCHEMBL27540372 0.75 SMN1; SMN2 (0.42) KMT2AMEN1MAPTALDH1A1KDM4E

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-5550218-A DISPERSE DYES FOR DYEING OR PRINTING TEXTILE MATERIALS MADES OF NATURAL, SYNTHETIC OR SEMI-SYNTHETIC HYDROPHOBIC ORGANIC MATERIALS SANDOZ LTD. (CH) 1996-08-27 US disclosed