SCHEMBL28293544

SCHEMBL28293544

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

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.68
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
ACLY P53396 2/20 0.33
CA2 P00918 3/20 0.32
CA1 P00915 2/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 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
SCHEMBL756868 0.90 THRB (0.54) THRBALDH1A1TSHRACLY
SCHEMBL3221520 0.83 THRB (0.46) THRBALDH1A1TSHRACLY
Ethane SCHEMBL28102526 0.82 THRB (0.90) THRBALDH1A1TSHRACLYCA2
Fluoromethane SCHEMBL21437550 0.82 THRB (0.90) THRBALDH1A1TSHRACLYCA2
Fluoromethane SCHEMBL27867584 0.82 THRB (0.90) THRBALDH1A1TSHRACLYCA2
SCHEMBL25223581 0.81 THRB (1.00) THRBALDH1A1ACLYCA2CA1
SCHEMBL3628434 0.81 THRB (1.00) THRBALDH1A1ACLYCA2CA1
SCHEMBL337248 0.81 THRB (1.00) THRBALDH1A1ACLYCA2CA1
SCHEMBL20657170 0.81 THRB (1.00) THRBALDH1A1ACLYCA2CA1
SCHEMBL2106472 0.81 THRB (1.00) THRBALDH1A1ACLYCA2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109836714-A A kind of diatomite insulation board and preparation method thereof with flameproof effect 广西鼎康科技股份有限公司 2019-06-04 CN claimed
CN-106117043-A The synthetic method of medical material 3-methyl perfluoro octanoic acid 无锡乾浩生物医药有限公司 2016-11-16 CN claimed
CN-109836714-A A kind of diatomite insulation board and preparation method thereof with flameproof effect 广西鼎康科技股份有限公司 2019-06-04 CN disclosed
CN-109836714-A A kind of diatomite insulation board and preparation method thereof with flameproof effect 广西鼎康科技股份有限公司 2019-06-04 CN disclosed
CN-106117043-A The synthetic method of medical material 3-methyl perfluoro octanoic acid 无锡乾浩生物医药有限公司 2016-11-16 CN disclosed
CN-106117043-A The synthetic method of medical material 3-methyl perfluoro octanoic acid 无锡乾浩生物医药有限公司 2016-11-16 CN disclosed
CN-106117043-A The synthetic method of medical material 3-methyl perfluoro octanoic acid 无锡乾浩生物医药有限公司 2016-11-16 CN disclosed