SCHEMBL31040447

SCHEMBL31040447

NCCCCCCCCN(CC(=O)O)C(=O)CCCCCN

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
THRB P10828 2/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
PLG P00747 1/20 0.52
ALOX15 P16050 1/20 0.52
SLC6A2 P23975 1/20 0.52
RECQL P46063 1/20 0.52
SLC6A3 Q01959 1/20 0.52
CYP2D6 P10635 1/20 0.48
NFKB1 P19838 1/20 0.48
BLM P54132 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ACHE P22303 1/20 0.46
HDAC3 O15379 3/20 0.43
HDAC4 P56524 3/20 0.43
HDAC1 Q13547 3/20 0.43
HDAC7 Q8WUI4 3/20 0.43
HDAC2 Q92769 3/20 0.43

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
SCHEMBL31040408 1.00 LMNA (0.52) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL8262546 0.87 LMNA (0.65) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL15065508 0.87 LMNA (0.65) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL16568984 0.86 GPR84 (0.46) KMT2AMEN1ALDH1A1ALOX15HDAC11
SCHEMBL9394255 0.82 TDP1 (0.48) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL1078743 0.81 LMNA (0.47) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL31040391 0.81 LMNA (0.57) LMNATHRBKMT2AMEN1ALDH1A1
SCHEMBL28892981 0.81 KDM5A (0.53) KMT2AMEN1ALDH1A1ALOX15HDAC11
SCHEMBL28892926 0.81 KDM5A (0.53) KMT2AMEN1ALDH1A1ALOX15HDAC11
SCHEMBL28892817 0.81 KDM5A (0.53) KMT2AMEN1ALDH1A1ALOX15HDAC11

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