SCHEMBL9640635

SCHEMBL9640635

CC(Cc1ccccc1)N1CC(c2ccccc2)OCC1=O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MOGAT2 Q3SYC2 1/20 0.39
DAO P14920 1/20 0.37
TSHR P16473 2/20 0.36
HPGD P15428 1/20 0.36
CNR2 P34972 2/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HSD17B2 P37059 1/20 0.35
ACE P12821 2/20 0.35
MME P08473 1/20 0.35
ALDH1A1 P00352 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL9239754 0.81 TDP1 (0.43) TDP1MEN1KMT2AMOGAT2DAO
SCHEMBL9678523 0.76 MEN1 (0.48) MEN1KMT2AMOGAT2CNR2
Hydrochloric Acid SCHEMBL9642007 0.75 MEN1 (0.47) MEN1KMT2AMOGAT2CNR2
SCHEMBL8069310 0.74 KMT2A (0.46) KMT2AHPGDCYP3A4CYP2D6SLC6A2
SCHEMBL2298696 0.73 TP53 (0.43) KMT2A
SCHEMBL2294656 0.73 TP53 (0.43) KMT2A
SCHEMBL2297220 0.73 TP53 (0.43) KMT2A
SCHEMBL2295368 0.73 TP53 (0.43) KMT2A
SCHEMBL25649058 0.72 CYP2D6 (0.55) KMT2ATSHRCYP3A4CYP2D6SLC6A2
SCHEMBL917086 0.72 MDM2 (0.47) KMT2ACYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0290122-B1 MORPHOLINE DERIVATIVES AND THEIR USE BEECHAM GROUP PLC (GB) 1992-12-23 EP disclosed
US-5082840-A Animal growth regulators BEECHAM GROUP P.L.C. (GB) 1992-01-21 US disclosed
US-4914202-A FOR IMPROVING FEED EFFICIENCY IN LIVESTOCK BEECHAM GROUP P.L.C. (GB) 1990-04-03 US disclosed
EP-0290122-A1 Morpholine derivatives and their use BEECHAM GROUP PLC (GB) 1988-11-09 EP disclosed