SCHEMBL30904656

SCHEMBL30904656

NCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
USP2 O75604 1/20 0.37
MAPT P10636 1/20 0.37
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2C9 P11712 1/20 0.35
RECQL P46063 1/20 0.35
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL8351857 0.92 CYP1A2 (0.34) TSHRUSP2MAPTCYP1A2CYP2C19
SCHEMBL9945698 0.80
SCHEMBL64572 0.80
SCHEMBL62987 0.76
SCHEMBL4802674 0.76
Hydrochloric Acid SCHEMBL23824986 0.76 AOC1 (0.31)
SCHEMBL8005736 0.76
SCHEMBL4803661 0.76
SCHEMBL4809019 0.76
SCHEMBL4809083 0.76

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
WO-2024096357-A1 FLUORINE-BASED COMPOUND, PHOTOPOLYMERIZABLE COMPOSITION, HOLOGRAM RECORDING MEDIUM, METHOD FOR MANUFACTURING SAME, AND OPTICAL ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-05-10 WO disclosed