SCHEMBL7741238

SCHEMBL7741238

CCOC(=O)C(Cc1c(OC)ccc2ccccc12)C(=O)OCC

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NCEH1 Q6PIU2 3/20 0.48
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 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
SCHEMBL7735713 0.86 KMT2A (0.53) MEN1KMT2ANCEH1ALDH1A1LMNA
SCHEMBL14627572 0.81 MMP8 (0.46) MEN1KMT2ANCEH1ALDH1A1LMNA
SCHEMBL9054624 0.81 TDP1 (0.47) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL490064 0.79 ALDH1A1 (0.43) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL14518817 0.76 MAPT (0.55) MEN1KMT2AMAPT
SCHEMBL6719502 0.76 CTNNB1 (0.59) KMT2AALDH1A1HPGD
SCHEMBL6621817 0.75 KMT2A (0.48) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL17502669 0.74 KDM4E (0.53) MEN1KMT2ANCEH1ALDH1A1LMNA
SCHEMBL11893003 0.74 KMT2A (0.60) MEN1KMT2ANCEH1MAPT
SCHEMBL7153174 0.74 NPC1 (0.48) KMT2ANCEH1ALDH1A1MAPTHPGD

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-6423870-B1 ANTICOAGULANTS; CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS LES LABORATOIRES SERVIER (FR) 2002-07-23 US disclosed