SCHEMBL29307355

SCHEMBL29307355

N[C@@H]1CCCN(CC(=O)N2CCC(O)CC2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
BIRC2 Q13490 1/20 0.41
DPP4 P27487 3/20 0.36
DPP7 Q9UHL4 2/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
RAB9A P51151 1/20 0.34
MAPT P10636 1/20 0.34
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33

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
SCHEMBL6997588 0.77 GAA (0.46) GAAMEN1KMT2ABIRC2ALDH1A1
SCHEMBL3450464 0.76 ALDH1A1 (0.44) GAAMEN1KMT2ABIRC2ALDH1A1
SCHEMBL1008007 0.76 KDM4E (0.42) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL1007467 0.76 KDM4E (0.42) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL1006794 0.76 KDM4E (0.42) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL26089493 0.76 HSD17B10 (0.38) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL29307370 0.76 HSD17B10 (0.38) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL12226502 0.75 HRH2 (0.37) MEN1KMT2ABIRC2ALDH1A1LMNA
SCHEMBL14115761 0.75 GAA (0.68) GAAKMT2ABIRC2ALDH1A1LMNA
SCHEMBL12226495 0.75 HRH2 (0.37) MEN1KMT2ABIRC2ALDH1A1LMNA

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
WO-2024148029-A2 ORGANIC COMPOUNDS AS NLRP3 INHIBITORS KODIAK SCIENCES INC. (US) 2024-07-11 WO disclosed