SCHEMBL5364934

SCHEMBL5364934

C=CCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCC=C

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
MAPT P10636 3/20 0.57
ABCC4 O15439 1/20 0.57
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
LMNA P02545 1/20 0.55
FAAH O00519 3/20 0.52
EPHX2 P34913 2/20 0.47
CNR1 P21554 4/20 0.46
HPGD P15428 2/20 0.46
CNR2 P34972 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
MEN1 O00255 1/20 0.46
ALOX12 P18054 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SLC6A5 Q9Y345 1/20 0.46

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
SCHEMBL13989568 0.94 ALDH1A1 (0.59) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL11327693 0.94 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL14125419 0.94 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL5708430 0.94 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL14972387 0.94 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL5367095 0.94 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL11343540 0.92 ALDH1A1 (0.60) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL16493204 0.91 ALDH1A1 (0.56) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL255242 0.90 ALDH1A1 (0.59) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL3967869 0.90 ALDH1A1 (0.59) ALDH1A1MAPTABCC4TSHRSMN1; SMN2

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-7300986-B2 Polyepoxy compounds having an amide linkage DOW3GLOBAL TECHNOLOGIES INC. (US) 2007-11-27 US disclosed
US-7300986-B2 Polyepoxy compounds having an amide linkage DOW3GLOBAL TECHNOLOGIES INC. (US) 2007-11-27 US disclosed
US-7300986-B2 Polyepoxy compounds having an amide linkage DOW3GLOBAL TECHNOLOGIES INC. (US) 2007-11-27 US disclosed
US-20050256277-A1 Polyepoxy compounds having an amide linkage BRENNAN DAVID J 2005-11-17 US disclosed
EP-1434771-A1 POLYEPOXY COMPOUNDS HAVING AN AMIDE LINKAGE DOW GLOBAL TECHNOLOGIES INC. (US) 2004-07-07 EP disclosed
WO-2003031424-A1 POLYEPOXY COMPOUNDS HAVING AN AMIDE LINKAGE DOW GLOBAL TECHNOLOGIES INC. (US) 2003-04-17 WO disclosed