SCHEMBL8612376

SCHEMBL8612376

O=C(O)CC(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)C(F)F

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
USP2 O75604 1/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ACLY P53396 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HTT P42858 1/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 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
SCHEMBL8617020 1.00 TSHR (0.42) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL8612467 1.00 TSHR (0.42) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL8613509 1.00 TSHR (0.42) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL8619087 1.00 TSHR (0.42) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL1352227 1.00 TSHR (0.42) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL8616905 0.98 TSHR (0.40) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL8615910 0.91 TSHR (0.38) TSHRUSP2MAPTKDM4ETDP1
SCHEMBL8562549 0.84 ACLY (0.42) TSHRKDM4ETDP1ACLYCYP2C19
SCHEMBL8563267 0.84 ACLY (0.42) TSHRKDM4ETDP1ACLYCYP2C19
SCHEMBL11227427 0.82 ACLY (0.44) TSHRKDM4ETDP1ACLYCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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