SCHEMBL8417399

SCHEMBL8417399

Cc1cc(O)ccc1C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.34
ESR2 Q92731 8/20 0.34
ALOX15 P16050 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
NR1I2 O75469 1/20 0.33
CYP2C9 P11712 1/20 0.33
MIF P14174 1/20 0.33
TYR P14679 1/20 0.33
HTT P42858 1/20 0.33
NFE2L2 Q16236 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KCNJ11 Q14654 1/20 0.33
CYP3A4 P08684 1/20 0.33
CHRM1 P11229 1/20 0.33
MAOA P21397 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
KIF11 P52732 1/20 0.33

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
SCHEMBL10794890 0.81 TYR (0.35) ESR1ESR2ALOX15ALDH1A1LMNA
SCHEMBL10293003 0.78 LMNA (0.36) LMNAPGK1PGK2
SCHEMBL11995382 0.78 LMNA (0.36) LMNAPGK1PGK2
SCHEMBL5358958 0.77 ESR2 (0.38) ESR1ESR2ALOX15ALDH1A1LMNA
SCHEMBL9694190 0.77 KIF11 (0.47) ESR1ESR2ALOX15ALDH1A1LMNA
SCHEMBL29426965 0.77 KIF11 (0.47) ESR1ESR2ALOX15ALDH1A1LMNA
SCHEMBL2958390 0.76 PGK1 (0.34) LMNAPGK1PGK2
SCHEMBL17286684 0.76 AR (0.46) ESR1ESR2ALOX15ALDH1A1LMNA
SCHEMBL17287089 0.76 KCNJ11 (0.49) ESR1ESR2ALOX15ALDH1A1LMNA
SCHEMBL18535798 0.75 ESR2 (0.44) ESR1ESR2ALOX15ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0597128-B1 ESTER POLYMER, PRODUCTION THEREOF, AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR MADE THEREFROM IDEMITSU KOSAN CO (JP) 1999-09-15 EP disclosed
EP-0837085-A1 POLYCARBONATE-BASE POLYMER, PRODUCTION PROCESS, RESIN COATING FLUID PREPARED THEREFROM, AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR PREPARED THEREFROM IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-04-22 EP disclosed
EP-0582722-B1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR MADE FROM POLYCARBONATE POLYMER IDEMITSU KOSAN CO (JP) 1997-11-12 EP disclosed
US-5561017-A A CHARGE TRANSFER COMPOUND AND/OR BINDER COMPRISING A POLYESTER OR -CARBONATE OF AN ARYL HYDRAZONE MONOMER; ELECTROGRAPHY; PLATES; WEAR RESISTANCE IDEMITSU KOSAN CO., LTD. (JP) 1996-10-01 US disclosed
US-5521041-A IMPROVED DURABILITY, NONCLOUDY, FLUORINE CONTAINING END GROUPS IDEMITSU KOSAN CO., LTD. (JP) 1996-05-28 US disclosed
US-5506331-A POLYESTER OR POLYCARBONATE HAVING HYDRAZONE STRUCTURE IN REPEATING UNITS, USABLE AS CHARGE TRANSPORT MATERIAL OR BINDER RESIN IN CHARGE TRANSPORT LAYER IDEMITSU KOSAN CO., LTD. (JP) 1996-04-09 US disclosed
EP-0597128-A1 ESTER POLYMER, PRODUCTION THEREOF, AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR MADE THEREFROM IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-05-18 EP disclosed
EP-0582722-A1 POLYCARBONATE POLYMER, PRODUCTION THEREOF, AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR MADE THEREFROM IDEMITSU KOSAN COMPANY LIMITED (JP) 1994-02-16 EP disclosed