SCHEMBL6231100

SCHEMBL6231100

FC(F)(F)C(c1ccc(N(CC2CO2)CC2CO2)cc1)(c1ccc(N(CC2CO2)CC2CO2)cc1)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
NR1H2 P55055 6/20 0.36
NR1H3 Q13133 6/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
CYP1A2 P05177 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PPARG P37231 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL6232668 0.91 MEN1 (0.36) ESR1ESR2NR1H2NR1H3MEN1
SCHEMBL132721 0.82 MEN1 (0.43) MEN1KMT2ALMNATP53TSHR
SCHEMBL30793029 0.80 CETP (0.40) TP53TSHRALDH1A1HIF1A
SCHEMBL30793045 0.80 NR3C1 (0.35) MEN1KMT2ALMNATP53MAPT
SCHEMBL18084085 0.79 MEN1 (0.51) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL1290461 0.79 MEN1 (0.51) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL10159853 0.79 MEN1 (0.51) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL14354443 0.78 LTA4H (0.40) MEN1KMT2ALMNATP53MAPT
SCHEMBL1643921 0.76 MEN1 (0.40) MEN1KMT2ALMNATP53TSHR
SCHEMBL16315930 0.75 MEN1 (0.37) ESR1ESR2MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023182141-A1 EPOXY COMPOUND, EPOXY RESIN, EPOXY RESIN COMPOSITION, CURED PRODUCT, PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, PRODUCING METHODS THEREFOR, SEALING MATERIAL, SEMICONDUCTOR DEVICE, METHOD FOR SEALING SEMICONDUCTOR ELEMENT, AND METHOD FOR USING SAME AS SEALING MATERIAL セントラル硝子株式会社 2023-09-28 WO disclosed
WO-2023136269-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2023-07-20 WO disclosed
EP-0840161-B1 LIQUID CRYSTAL ALIGNING AGENT JSR CORP (JP) 2005-04-06 EP disclosed
US-5969055-A MIXTURES OF POLYAMIC ACIDS AND IMIDIZED POLYMERS FROM THE DEHYDRATION AND RING CLOSURE OF POLYAMIC ACID, THE POLYMERS HAVING HIGHER IMIDIZATION DEGREE ALSO HAVE SMALLER SURFACE FREE ENERGY, FILMS, HIGH PRETILT ANGLE, LOW IMAGE RETENTION JSR CORPORATION (JP) 1999-10-19 US disclosed
EP-0840161-A1 LIQUID CRYSTAL ALIGNING AGENT JSR Corporation (JP) 1998-05-06 EP disclosed