SCHEMBL7277137

SCHEMBL7277137

CN(CC(=O)O)C(=O)CC[C]=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MVD P53602 1/20 0.39
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 2/20 0.31
EYA2 O00167 1/20 0.31
APP P05067 1/20 0.31
ACE P12821 1/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.31
EPHX2 P34913 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
CHRM2 P08172 1/20 0.30
ADRA2A P08913 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
DRD1 P21728 1/20 0.30
SLC6A2 P23975 1/20 0.30

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
SCHEMBL7664477 0.78 LMNA (0.34) NPC1RAB9ALMNA
SCHEMBL6228115 0.76 FFAR3 (0.48) MVDPHF8KDM2ANPC1RAB9A
SCHEMBL2804753 0.76 EPHX2 (0.46) MVDPHF8KDM2ATDP1EPHX2
SCHEMBL6826759 0.75
SCHEMBL11737268 0.74 MVD (0.41) MVDPHF8KDM2ANPC1RAB9A
SCHEMBL28427604 0.74 PHF8 (0.41) MVDPHF8KDM2ANPC1RAB9A
SCHEMBL29434566 0.74 SLC22A6 (0.50) MVDPHF8KDM2AEPHX2LMNA
SCHEMBL4590256 0.74 MVD (0.41) MVDPHF8KDM2ANPC1RAB9A
SCHEMBL5664495 0.73
SCHEMBL6936379 0.72 ALDH1A1 (0.58) TDP1APPKMT2AEPHX2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210024919-A1 FUNCTIONALIZED SOLID SUPPORT MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2021-01-28 US claimed
US-20200256862-A1 FUNCTIONALIZED SOLID SUPPORT MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2020-08-13 US claimed
EP-0384341-A2 New proline derivatives KABUSHIKI KAISHA YAKULT HONSHA (JP) 1990-08-29 EP claimed
US-20210024919-A1 FUNCTIONALIZED SOLID SUPPORT MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2021-01-28 US disclosed
US-20200256862-A1 FUNCTIONALIZED SOLID SUPPORT MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2020-08-13 US disclosed
US-5340802-A Central nervous system disorders ABBOTT LABORATORIES (US) 1994-08-23 US disclosed
EP-0384341-A2 New proline derivatives KABUSHIKI KAISHA YAKULT HONSHA (JP) 1990-08-29 EP disclosed