SCHEMBL18217156

SCHEMBL18217156

CCCCC(CC)CCc1ccc(-c2ccc(-c3c4nsnc4c(-c4ccc(-c5ccc(CCC(CC)CCCC)cc5)s4)c4nc(C)c(C)nc34)s2)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ EIF4A1 P60842 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL20176719 0.91 SMN1; SMN2 (0.32) SMN1; SMN2PTPN1EIF4A1ALDH1A1LMNA
SCHEMBL20176716 0.91 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1LMNAPOLBHTT
SCHEMBL18217174 0.89 KDM4E (0.32) SMN1; SMN2PTPN1EIF4A1
SCHEMBL20176728 0.88 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1LMNAPOLBHTT
SCHEMBL21241720 0.86 PTPN1 (0.37) SMN1; SMN2PTPN1EIF4A1ALDH1A1LMNA
SCHEMBL20182413 0.86 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL20176717 0.86 KDM4E (0.41) SMN1; SMN2PTPN1EIF4A1ALDH1A1LMNA
SCHEMBL18217198 0.86 ALOX15B (0.32) SMN1; SMN2PTPN1HTTL3MBTL1
SCHEMBL19798373 0.85 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1LMNAPOLBHTT
SCHEMBL18217140 0.84 GCGR (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10738240-B2 Thiadiazoloquinoxaline derivatives MERCK PATENT GMBH (DE) 2020-08-11 — — US disclosed
US-20180142153-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-24 — — US disclosed
US-20180142153-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-24 — — US disclosed
WO-2016177449-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-11-10 — — WO disclosed
Send feedback