SCHEMBL7629952

SCHEMBL7629952

C=CCN(CC=C)C(=O)CCCCCCCC(=O)N(CC=C)CC=C

nearest known ligand 0.86

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.86
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 3/20 0.41
ABCC4 O15439 1/20 0.41
LMNA P02545 4/20 0.41
POLB P06746 1/20 0.40
TSHR P16473 3/20 0.37
FAAH O00519 1/20 0.34
RAB9A P51151 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
CCR6 P51684 1/20 0.33
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32

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
SCHEMBL15049827 1.00 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2MAPTABCC4LMNA
SCHEMBL13630658 1.00 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2MAPTABCC4LMNA
SCHEMBL8068413 0.98 ALDH1A1 (0.91) ALDH1A1SMN1; SMN2MAPTABCC4LMNA
SCHEMBL17141436 0.92 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2MAPTABCC4LMNA
SCHEMBL17152923 0.90 ALDH1A1 (0.70) ALDH1A1SMN1; SMN2MAPTABCC4LMNA
SCHEMBL4243964 0.90 ALDH1A1 (0.70) ALDH1A1LMNATSHRFAAH
SCHEMBL4019233 0.90 ALDH1A1 (0.70) ALDH1A1LMNATSHRFAAH
SCHEMBL11564777 0.90 ALDH1A1 (0.70) ALDH1A1LMNATSHRFAAH
SCHEMBL4245319 0.90 ALDH1A1 (0.70) ALDH1A1LMNATSHRFAAH
SCHEMBL570411 0.90 ALDH1A1 (0.70) ALDH1A1LMNATSHRFAAH

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6350841-B1 ALLYLAMIDE COMPOUNDS, CURING AGENTS, PHOTOINITIATORS WITH FILLERS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2002-02-26 US disclosed
US-6350840-B1 ALLYLAMIDE COMPOUNDS, CURING AGENTS, PHOTOINITIATORS WITH FILLERS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2002-02-26 US disclosed
EP-0970946-A2 Allylated amide compounds and die attach adhesives prepared therefrom National Starch and Chemical Investment Holding Corporation (US) 2000-01-12 EP disclosed
EP-0969061-A2 Underfill encapsulants prepared from allylated amide compounds National Starch and Chemical Investment Holding Corporation (US) 2000-01-05 EP disclosed
EP-0969028-A2 Circuit composition comprising allylated amide compounds National Starch and Chemical Investment Holding Corporation (US) 2000-01-05 EP disclosed
EP-0969066-A2 Package encapsulants prepared from allyated amide compounds National Starch and Chemical Investment Holding Corporation (US) 2000-01-05 EP disclosed