SCHEMBL5367095

SCHEMBL5367095

C=CCCCCCCCCC(=O)NCCCNC(=O)CCCCCCCCC=C

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
MAPT P10636 2/20 0.55
ABCC4 O15439 1/20 0.55
TSHR P16473 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 1/20 0.53
EPHX2 P34913 2/20 0.50
FAAH O00519 2/20 0.50
SLC6A5 Q9Y345 2/20 0.49
KDM4E B2RXH2 1/20 0.46
LPAR1 Q92633 1/20 0.46
CNR1 P21554 1/20 0.45
HPGD P15428 1/20 0.45
TRPV1 Q8NER1 1/20 0.45

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
SCHEMBL11327693 0.96 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL14972387 0.96 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL5708430 0.96 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL5364934 0.94 ALDH1A1 (0.66) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL11343540 0.94 ALDH1A1 (0.60) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL13989562 0.93 ALDH1A1 (0.56) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL14125419 0.92 ALDH1A1 (0.63) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL14125363 0.92 ALDH1A1 (0.58) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL15362884 0.91 ALDH1A1 (0.54) ALDH1A1MAPTABCC4TSHRSMN1; SMN2
SCHEMBL14972492 0.91 ALDH1A1 (0.58) 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