SCHEMBL29040282

SCHEMBL29040282

O=C(OCCCCCCCCO)c1cccnc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.76
L3MBTL1 Q9Y468 1/20 0.71
MAPT P10636 4/20 0.63
ALDH1A1 P00352 4/20 0.63
KMT2A Q03164 4/20 0.63
MEN1 O00255 2/20 0.63
HPGD P15428 1/20 0.63
TDP1 Q9NUW8 3/20 0.56
NFKB1 P19838 2/20 0.53
NFKB2 Q00653 2/20 0.53
RELA Q04206 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
NPC1 O15118 1/20 0.53
POLB P06746 1/20 0.53
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 1/20 0.51
USP2 O75604 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
Iodide SCHEMBL7579160 0.98 LMNA (0.74) LMNAL3MBTL1MAPTALDH1A1KMT2A
Bromide SCHEMBL7571294 0.98 LMNA (0.74) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL18668975 0.98 LMNA (0.74) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL7285060 0.94 L3MBTL1 (0.75) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL31161094 0.94 L3MBTL1 (0.75) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL21243071 0.92 LMNA (0.82) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL25009811 0.89 L3MBTL1 (0.82) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL28174525 0.88 LMNA (0.76) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL28174523 0.88 LMNA (0.76) LMNAL3MBTL1MAPTALDH1A1KMT2A
SCHEMBL28174527 0.88 LMNA (0.76) LMNAL3MBTL1MAPTALDH1A1KMT2A

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-116490598-A Detergent compositions with enhanced efficacy delivery of substances 株式会社LG生活健康 2023-07-25 CN disclosed