SCHEMBL8166647

SCHEMBL8166647

CCCc1c(F)c(F)c(O)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.38
DBH P09172 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
LDHA P00338 1/20 0.32
LDHB P07195 1/20 0.32
HMGCR P04035 1/20 0.30

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
SCHEMBL9502717 0.93 ESR1 (0.35) ESR1DBH
SCHEMBL10336447 0.87 ESR1 (0.33) ESR1
SCHEMBL5587884 0.85 LDHA (0.33) ESR1KDM4EALDH1A1HPGDLDHA
SCHEMBL5586788 0.85 LDHA (0.33) ESR1KDM4EALDH1A1HPGDLDHA
SCHEMBL172098 0.83 SLC6A2 (0.31) KDM4EALDH1A1HPGD
SCHEMBL16575391 0.80 KDM4E (0.32) KDM4EALDH1A1HPGD
SCHEMBL9504320 0.80 ESR1 (0.41) ESR1KDM4EALDH1A1HPGD
SCHEMBL10985455 0.79 GCGR (0.38)
SCHEMBL9505791 0.78 ESR1 (0.40) ESR1KDM4EALDH1A1HPGD
SCHEMBL10158116 0.78 ESR1 (0.36) ESR1DBH

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
CN-111511558-A Multilayer body 帝人株式会社 2020-08-07 CN disclosed
US-6139322-A A BLENDS COMPRISING AN INTERPENETRATING POLYMER NETWORK POLYMERIC MATRIX AND A SELF-LUBRICATING SWOLLEN CROSSLINKED PARTICLES; USE IN DENTAL PROSTHESIS SUCH AS ARTIFICIAL TEETH, INLAYS, ONLAYS, FACINGS, CROWNS, BRIDGES, ARTIFICIAL BONE DENTSPLY RESEARCH & DEVELOPMENT CORP (US) 2000-10-31 US disclosed
EP-0427300-A1 Interpenetrating polymer network compositions DENTSPLY INTERNATIONAL, INC. (US) 1991-05-15 EP disclosed
EP-0142747-A2 Interpenetrating polymer network compositions employing rubber-modified polymers DENTSPLY INTERNATIONAL, INC. (US) 1985-05-29 EP disclosed