SCHEMBL27884591

SCHEMBL27884591

CCC(=O)C1(c2ccccc2F)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 5/20 0.53
ELOVL1 Q9BW60 2/20 0.42
GAA P10253 1/20 0.41
OPRL1 P41146 3/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
HDAC9 Q9UKV0 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL27851055 0.81 HDAC4 (0.54) HDAC4ELOVL1OPRL1
SCHEMBL20326814 0.79 HDAC4 (0.38) HDAC4
SCHEMBL19242787 0.79 HDAC4 (0.52) HDAC4GAAMAPTTP53THRB
SCHEMBL301133 0.78 HDAC4 (0.59) HDAC4ELOVL1OPRL1
SCHEMBL1259168 0.78 HDAC4 (0.59) HDAC4ELOVL1OPRL1MAPTTHRB
SCHEMBL31125559 0.78 HDAC4 (0.59) HDAC4ELOVL1OPRL1
SCHEMBL5845612 0.78 HDAC4 (0.59) HDAC4GAAMAPTTP53THRB
SCHEMBL5844360 0.77 HDAC4 (0.58) HDAC4GAAMAPTTP53THRB
SCHEMBL20241935 0.77 HDAC4 (0.57) HDAC4ELOVL1OPRL1MAPTTHRB
SCHEMBL4744830 0.77 HDAC4 (0.57) HDAC4ELOVL1OPRL1MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109810573-A Inorganic nano material prints ink and its preparation method and application TCL集团股份有限公司 2019-05-28 CN claimed
CN-107779033-A A kind of solar energy heat absorbing material 广西吉宽太阳能设备有限公司 2018-03-09 CN claimed
CN-107256678-A A kind of electronic information display 南京信息工程大学 2017-10-17 CN claimed
CN-106189609-A A kind of solar energy heat absorbing coating of high-absorbility 南宁可煜能源科技有限公司 2016-12-07 CN claimed
CN-102643180-A Preparation method of 2-halogenated-2-(2-fluorophenyl)-1-cyclopropylethanone UNIV GUANGDONG PHARM 2012-08-22 CN claimed
CN-108864874-A Anticoagulant ice coating coated on road surface 重庆交通大学 2018-11-23 CN disclosed
CN-108727936-A A kind of road surface anti-icing method 重庆交通大学 2018-11-02 CN disclosed
CN-107256678-A A kind of electronic information display 南京信息工程大学 2017-10-17 CN disclosed
CN-104592250-A Low-cost environment-friendly preparation method of prasugrel XINFA PHARMACEUTICAL CO LTD 2015-05-06 CN disclosed
CN-102643180-A Preparation method of 2-halogenated-2-(2-fluorophenyl)-1-cyclopropylethanone UNIV GUANGDONG PHARM 2012-08-22 CN disclosed