SCHEMBL15329583

SCHEMBL15329583

CC[C@@H](C)[C@H](NC(=O)O)c1ncc(C=O)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.33
LMNA P02545 3/20 0.32
TSHR P16473 2/20 0.32
ELANE P08246 1/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
TP53 P04637 2/20 0.32
XBP1 P17861 2/20 0.32
MAPK1 P28482 2/20 0.32
HTT P42858 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
HSD17B10 Q99714 2/20 0.32
JAK2 O60674 1/20 0.32
S1PR4 O95977 1/20 0.32
F2 P00734 1/20 0.32
HSP90AA1 P07900 1/20 0.32
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
HCAR3 P49019 1/20 0.30
POLB P06746 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
SCHEMBL15330832 1.00 FAAH (0.33) FAAHLMNATSHRELANEALDH1A1
SCHEMBL2560419 0.86 FAAH (0.33) FAAHHCAR3
SCHEMBL15331693 0.80 FAAH (0.34) FAAHLMNAALDH1A1HPGD
SCHEMBL2555224 0.68 L3MBTL1 (0.41) TSHRHPGDMAPK1
SCHEMBL677190 0.64 KMT2A (0.51) LMNATSHRALDH1A1HPGDTP53
SCHEMBL15106308 0.60 NPC1 (0.42) LMNATSHRALDH1A1HPGDTP53
SCHEMBL29160549 0.60 ALDH1A1 (0.40) ALDH1A1CYP2C19
SCHEMBL6729274 0.58 ALDH1A1 (0.45) ALDH1A1PKMCYP2C19
SCHEMBL15302508 0.55 ALDH1A1 (0.68) ALDH1A1MAPK1CYP2C9CYP2C19
SCHEMBL15302507 0.55 ALDH1A1 (0.68) ALDH1A1MAPK1CYP2C9CYP2C19

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
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed