SCHEMBL8962646

SCHEMBL8962646

Oc1ccccc1-c1ccc(-c2ccccc2)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.58
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
BCL2L1 Q07817 1/20 0.58
ALOX15 P16050 3/20 0.56
IDO1 P14902 2/20 0.47
BIRC5 O15392 1/20 0.46
PIM1 P11309 1/20 0.46
MGAM O43451 1/20 0.46
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
ALOX12 P18054 1/20 0.44
NFKB1 P19838 1/20 0.44
MAPK1 P28482 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADORA2A P29274 2/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL8962806 0.89 IDO1 (0.56) HSD17B10ALDH1A1HPGDBCL2L1ALOX15
SCHEMBL8962884 0.85 HPGD (0.46) HSD17B10ALDH1A1HPGDBCL2L1ALOX15
SCHEMBL1536003 0.79 NOTUM (0.56) HSD17B10ALDH1A1HPGDIDO1MAPT
SCHEMBL18787989 0.77 NOTUM (0.54) HSD17B10ALDH1A1IDO1MAPTSMN1; SMN2
SCHEMBL8962611 0.76 MMP3 (0.64) HSD17B10BCL2L1KDM4EMEN1KMT2A
SCHEMBL8962876 0.75 IDO1 (0.47) HSD17B10ALDH1A1HPGDBCL2L1ALOX15
SCHEMBL21686770 0.75 HPGD (0.47) HSD17B10ALDH1A1HPGDBCL2L1ALOX15
SCHEMBL28366972 0.74 ALDH1A1 (1.00) HSD17B10ALDH1A1HPGDBCL2L1ALOX15
2-Phenylphenol SCHEMBL14249267 0.74 ALDH1A1 (1.00) HSD17B10ALDH1A1HPGDBCL2L1ALOX15
2-Phenylphenol SCHEMBL29360750 0.74 ALDH1A1 (1.00) HSD17B10ALDH1A1HPGDBCL2L1ALOX15

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-5543286-A CONTAINING AN ORGANIC SILVER SALT AND A PYRROLE COMPOUND;HIGH CONTRAST IMAGES CANON KABUSHIKI KAISHA (JP) 1996-08-06 US claimed
US-5543286-A CONTAINING AN ORGANIC SILVER SALT AND A PYRROLE COMPOUND;HIGH CONTRAST IMAGES CANON KABUSHIKI KAISHA (JP) 1996-08-06 US disclosed