SCHEMBL8327178

SCHEMBL8327178

CCOC(=O)C(CCCNC(C)C)(CC1CCCCC1)C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.39
METAP2 P50579 2/20 0.38
TSHR P16473 1/20 0.36
SIGMAR1 Q99720 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
THRB P10828 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PKM P14618 1/20 0.33
MMP2 P08253 1/20 0.32
BMP1 P13497 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL11005384 0.84 CYP1A2 (0.42) BCHEMETAP2TSHRMEN1KMT2A
SCHEMBL8331541 0.81 SIGMAR1 (0.38) METAP2SIGMAR1MEN1KMT2ATHRB
SCHEMBL8329421 0.81 METAP2 (0.40) METAP2MEN1KMT2ATHRBATM
SCHEMBL8328919 0.81 EPHX1 (0.46) METAP2TSHRMEN1KMT2A
SCHEMBL8332090 0.81 METAP2 (0.38) BCHEMETAP2TSHRSIGMAR1MEN1
SCHEMBL8331369 0.80 MEN1 (0.36) METAP2TSHRMEN1KMT2ATHRB
SCHEMBL8328587 0.80 EPHX1 (0.33) METAP2TSHRMEN1KMT2A
SCHEMBL5413788 0.76 KDM4E (0.38) METAP2MEN1KMT2ATHRBATM
SCHEMBL8329946 0.76 EPHX1 (0.49) METAP2TSHRMEN1KMT2A
SCHEMBL8328592 0.76 NFKB1 (0.34) METAP2

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-5908863-A ANTIGROWTH AGENT FOR BONES DOMPE' S.P.A. (IT) 1999-06-01 US disclosed
EP-0792878-A2 Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism Dompé S.P.A. (IT) 1997-09-03 EP disclosed