SCHEMBL9831013

SCHEMBL9831013

CC(C(=O)O)N1CCC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ACE P12821 1/20 0.40
LMNA P02545 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37

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
SCHEMBL10959845 0.88 LMNA (0.51) MEN1KMT2AACELMNACA12
SCHEMBL951298 0.88 LMNA (0.51) MEN1KMT2AACELMNACA12
SCHEMBL3728882 0.86 LMNA (0.46) MEN1KMT2AACELMNACA12
SCHEMBL11187859 0.84 LMNA (0.45) MEN1KMT2AACELMNACA12
SCHEMBL28109752 0.84 LMNA (0.45) MEN1KMT2AACELMNACA12
SCHEMBL17377717 0.79 KMT2A (0.40) MEN1KMT2AACECSNK2A2CSNK2B
SCHEMBL11517863 0.76 CYP3A4 (0.36) MEN1KMT2ALMNACA12CA1
SCHEMBL7068437 0.75 LMNA (0.40) MEN1KMT2ALMNACA12CA1
SCHEMBL5452977 0.75 MEN1 (0.37) MEN1KMT2AACECSNK2A2CSNK2B
SCHEMBL15110370 0.75 ALDH1A1 (0.39) MEN1KMT2AACELMNACSNK2A2

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
EP-0209352-B1 PROCESS AND INTERMEDIATES FOR BETA-LACTAM ANTIBIOTICS THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1991-05-02 EP disclosed