SCHEMBL7242146

SCHEMBL7242146

Oc1ccccc1-c1cccc(-c2cccc(Br)n2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.44
SMN1; SMN2 Q16637 6/20 0.40
MAPT P10636 4/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
MAPK10 P53779 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DCUN1D1 Q96GG9 2/20 0.40
ALOX15 P16050 3/20 0.39
HSD17B10 Q99714 3/20 0.39
TP53 P04637 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
SCHEMBL15563928 0.96 IDO1 (0.47) IDO1SMN1; SMN2MAPTRAB9AMEN1
SCHEMBL58204 0.88 IDO1 (0.48) IDO1SMN1; SMN2MAPTRAB9AMEN1
SCHEMBL2542176 0.88 IDO1 (0.48) IDO1SMN1; SMN2MAPTRAB9AMEN1
SCHEMBL6907528 0.86 IDO1 (0.50) IDO1SMN1; SMN2MAPTRAB9AMEN1
Hydrochloric Acid SCHEMBL7235410 0.84 SMN1; SMN2 (0.46) IDO1SMN1; SMN2MAPTRAB9AMEN1
SCHEMBL7234265 0.80 MEN1 (0.44) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL31354842 0.79 CCR1 (0.46) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL700152 0.79 CCR1 (0.46) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL5106112 0.79 MEN1 (0.61) IDO1SMN1; SMN2MAPTRAB9AMEN1
SCHEMBL5950612 0.78 SMN1; SMN2 (0.45) IDO1SMN1; SMN2MAPTRAB9AMEN1

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-6541490-B1 Treating ischemia or reoxygenation injury; preparation from a bipyridine, a benzeneboronic acid and a manganese salt EUKARION, INC. 2003-04-01 US disclosed
EP-1119573-A2 BIPYRIDINE MANGANESE COMPLEXES EUKARION, INC. (US) 2001-08-01 EP disclosed
US-6177419-B1 ANTIOXIDANT CHELATE COMPOUNDS FOR PREVENTING OXYGEN FREE RADICAL-ASSOCIATED DISEASES IN MAMMALS; NEUROPROTECTANTS, SUPEROXIDE DISMUTASE (SOD), CATALASE (CAT) AND/OR PEROXIDASE (POD) MIMETICS EUKARION, INC. 2001-01-23 US disclosed
WO-2000009512-A2 BIPYRIDINE MANGANESE COMPLEXES EUKARION, INC. (US) 2000-02-24 WO disclosed