SCHEMBL31040404

SCHEMBL31040404

NCCCCCCN[C@@H](CCCCN)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.53
GGT1 P19440 1/20 0.51
GSR P00390 1/20 0.48
CPB2 Q96IY4 4/20 0.47
RNPEP Q9H4A4 1/20 0.47
TLR2 O60603 2/20 0.47
NOD1 Q9Y239 1/20 0.47
SIRT6 Q8N6T7 1/20 0.45
SIRT1 Q96EB6 1/20 0.45
SLC6A5 Q9Y345 1/20 0.44
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
GNAI3 P08754 1/20 0.42
GNAO1 P09471 1/20 0.42
GNAI1 P63096 1/20 0.42
PAOX Q6QHF9 2/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL28397660 1.00 FOLH1 (0.53) FOLH1GGT1GSRCPB2RNPEP
Hydrochloric Acid SCHEMBL25352316 0.98 FOLH1 (0.51) FOLH1GGT1GSRCPB2RNPEP
SCHEMBL148480 0.98 FOLH1 (0.54) FOLH1GGT1GSRCPB2RNPEP
SCHEMBL7076576 0.98 FOLH1 (0.54) FOLH1GGT1GSRCPB2RNPEP
SCHEMBL31040389 0.96 GGT1 (0.51) FOLH1GGT1GSRCPB2RNPEP
Hydrochloric Acid SCHEMBL25353778 0.94 GGT1 (0.50) FOLH1GGT1GSRCPB2RNPEP
Hydrochloric Acid SCHEMBL25353775 0.94 GGT1 (0.50) FOLH1GGT1GSRCPB2RNPEP
SCHEMBL6316197 0.94 FOLH1 (0.54) FOLH1GGT1GSRCPB2RNPEP
SCHEMBL6859366 0.94 FOLH1 (0.54) FOLH1GGT1GSRCPB2RNPEP
SCHEMBL5500042 0.93 FOLH1 (0.47) FOLH1GGT1GSRCPB2RNPEP

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
CN-118510788-A Liposoamines 摩登纳特斯有限公司 2024-08-16 CN disclosed