SCHEMBL8080604

SCHEMBL8080604

CCc1c2c(c(-c3ccc4c(c3)OCO4)c3c4c(ccc13)OCO4)CNC2=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.50
BRD4 O60885 2/20 0.38
NQO2 P16083 1/20 0.36
PDE10A Q9Y233 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
RAB9A P51151 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
Dimethylamine SCHEMBL8081518 0.97 ALOX5 (0.47) ALOX5BRD4NQO2PDE10AMEN1
SCHEMBL8081513 0.87 ALOX5 (0.46) ALOX5BRD4NQO2PDE10AMEN1
SCHEMBL8084922 0.86 ALOX5 (0.53) ALOX5BRD4NQO2PDE10AMEN1
SCHEMBL8081635 0.84 ALOX5 (0.40) ALOX5BRD4NQO2PDE10AMEN1
SCHEMBL8080610 0.83 ALOX5 (0.50) ALOX5NQO2MEN1KMT2ARAB9A
SCHEMBL8085138 0.83 ALOX5 (0.46) ALOX5BRD4MEN1KMT2ARAB9A
Dimethylamine SCHEMBL8072362 0.82 ALOX5 (0.45) ALOX5BRD4MEN1KMT2AKDM4E
SCHEMBL8085156 0.81 ALOX5 (0.44) ALOX5BRD4MEN1KMT2AALDH1A1
SCHEMBL8085135 0.81 ALOX5 (0.47) ALOX5BRD4NQO2PDE10AMEN1
SCHEMBL8072357 0.79 ALOX5 (0.44) ALOX5BRD4MEN1KMT2ARAB9A

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-6030967-A AND/OR LIKE NEUROTROPHIC FACTOR (FOR EXAMPLE, NERVE GROWTH FACTOR (NGF), BRAIN-DERIVED NEUROTROPHIC FACTOR, NEUROTROPHIN-3, AND GLIAL CELL LINE-DERIVED NEUROTROPHIC FACTOR)-LIKE ACTIVITY; OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-02-29 US claimed
US-6030967-A AND/OR LIKE NEUROTROPHIC FACTOR (FOR EXAMPLE, NERVE GROWTH FACTOR (NGF), BRAIN-DERIVED NEUROTROPHIC FACTOR, NEUROTROPHIN-3, AND GLIAL CELL LINE-DERIVED NEUROTROPHIC FACTOR)-LIKE ACTIVITY; OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-02-29 US disclosed