SCHEMBL8108604

SCHEMBL8108604

COc1ccc2[nH]c(-c3nc4ccccc4[nH]3)nc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.69
SMN1; SMN2 Q16637 11/20 0.69
RAB9A P51151 10/20 0.69
ALDH1A1 P00352 8/20 0.69
KDM4E B2RXH2 6/20 0.69
PKM P14618 4/20 0.69
TP53 P04637 6/20 0.61
HPGD P15428 4/20 0.61
HSD17B10 Q99714 2/20 0.61
TSHR P16473 1/20 0.61
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
ABCB11 O95342 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
RUNX1 Q01196 1/20 0.56
KMT2A Q03164 6/20 0.54
MEN1 O00255 5/20 0.54
POLB P06746 3/20 0.54
LMNA P02545 2/20 0.54

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
SCHEMBL1170729 0.92 ALDH1A1 (0.57) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL3125413 0.90 NPC1 (0.75) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL4496832 0.87 NPC1 (0.57) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL2324292 0.86 NPC1 (0.78) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL4496843 0.85 NPC1 (0.68) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL4813791 0.83 NPC1 (0.58) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL2242715 0.82 NPC1 (1.00) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL31429762 0.82 GAA (0.66) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL15643913 0.82 SMN1; SMN2 (0.64) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E
SCHEMBL29269112 0.82 AMY1A (0.71) NPC1SMN1; SMN2RAB9AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6037473-A AS SUNSCREENS IN COSMETIC AND PHARMACEUTICAL PREPARATIONS; FOR ENHANCING PHOTOSTABILITY OF INDUSTRIAL PRODUCTS SUCH AS PAINTS, VARNISHES, PLASTICS, TEXTILES, PACKAGING MATERIALS AND RUBBERS HAARMANN & REIMER GMBH (DE) 2000-03-14 US disclosed
US-5961960-A Use of substituted benzazoles as UV absorbers, new benzazoles and processes for their preparation HAARMANN & REIMER GMBH (DE) 1999-10-05 US disclosed
EP-0843995-A2 Use of substituted benzazoles as UV absorbents, new benzazoles and their preparation HAARMANN & REIMER GMBH (DE) 1998-05-27 EP disclosed