SCHEMBL5050546

SCHEMBL5050546

CCCCCCNC(=N)c1cc(C(=O)O)c2c3c(ccc(C(=O)NCCCCCC)c13)C(=O)NC2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.41
▸ NAAA Q02083 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ALOX15 P16050 3/20 0.37
▸ GPR84 Q9NQS5 2/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ PLK1 P53350 1/20 0.35
▸ HTT P42858 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ APOBEC3A P31941 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35

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
SCHEMBL1095842 0.88 ALOX5 (0.39) ALOX5NAAAALDH1A1LMNASMN1; SMN2
SCHEMBL2524404 0.88 ALOX5 (0.39) ALOX5NAAAALDH1A1LMNASMN1; SMN2
SCHEMBL5051814 0.83 MAPT (0.42) ALDH1A1LMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL5185602 0.80 CASP3 (0.35) ALOX5ALDH1A1LMNAHTTL3MBTL1
SCHEMBL5053445 0.77 NPC1 (0.43) SMN1; SMN2KDM4E
SCHEMBL5056718 0.77 CHEK1 (0.43) ALDH1A1KDM4EPOLBHPGD
SCHEMBL9511404 0.77 KDM4E (0.38) ALDH1A1LMNASMN1; SMN2HTTL3MBTL1
SCHEMBL5056873 0.75 NAAA (0.59) ALOX5NAAAALDH1A1LMNASMN1; SMN2
SCHEMBL822462 0.75 NAAA (0.59) ALOX5NAAAALDH1A1LMNASMN1; SMN2
SCHEMBL54245 0.75 NAAA (0.59) ALOX5NAAAALDH1A1LMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1952453-A1 NAPHTHALENE BASED TETRACARBOXYLIC DIIMIDES AS SEMICONDUCTOR MATERIALS EASTMAN KODAK COMPANY (US) 2008-08-06 — — EP disclosed
WO-2007061614-A1 NAPHTHALENE BASED TETRACARBOXYLIC DIIMIDES AS SEMICONDUCTOR MATERIALS EASTMAN KODAK COMPANY (US) 2007-05-31 — — WO disclosed
Send feedback