SCHEMBL25873116

SCHEMBL25873116

c1ccc(-c2ccc(-c3ccccc3)c(-c3ccc(Oc4ccc(-c5c(-c6ccccc6)ccc(-c6ccccc6)c5-c5ccccc5)cc4)cc3)c2-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.55
LTA4H P09960 9/20 0.48
TSHR P16473 1/20 0.48
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
MAOA P21397 2/20 0.43
NR1H2 P55055 1/20 0.43
BAX Q07812 1/20 0.43
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SCN4A P35499 1/20 0.40
MAOB P27338 1/20 0.40
BACE1 P56817 1/20 0.39
TLR8 Q9NR97 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL10838290 0.89 GSTP1 (0.50) GSTP1LTA4HTSHRNCOA1NCOA3
SCHEMBL9730506 0.87 GSTP1 (0.57) GSTP1LTA4HTSHRNCOA1NCOA3
SCHEMBL6424885 0.86 GSTP1 (0.52) GSTP1LTA4HTSHRMAOANR1H2
SCHEMBL14390391 0.85 LMNA (0.48) NPC1RAB9ABACE1
SCHEMBL17552850 0.84 LTA4H (0.53) GSTP1LTA4HNPC1RAB9ABACE1
SCHEMBL11751812 0.83 GSTP1 (0.61) GSTP1LTA4HTSHRNCOA1NCOA3
SCHEMBL31613230 0.83 NCOA1 (0.61) GSTP1TSHRNCOA1NCOA3MAOA
SCHEMBL608536 0.83 ALDH1A1 (0.50) NPC1RAB9ABACE1
SCHEMBL9730500 0.81 NCOA1 (0.46) GSTP1LTA4HTSHRNCOA1NCOA3
SCHEMBL6331975 0.81 NCOA1 (0.64) GSTP1TSHRNCOA1NCOA3MAOA

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
US-20240016699-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INC (US) 2024-01-18 US disclosed
US-11707411-B2 Pharmaceutical packages with coatings comprising polycyanurates CORNING INCORPORATED (US) 2023-07-25 US disclosed