SCHEMBL809929

SCHEMBL809929

C=Cc1ccc(CCCCl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.37
THRB P10828 6/20 0.34
THRA P10827 5/20 0.34
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HDAC8 Q9BY41 1/20 0.32
MAPT P10636 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TP53 P04637 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 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
SCHEMBL3626758 0.94 ALDH1A1 (0.46) ALDH1A1TSHRTHRBTHRAPOLB
SCHEMBL3620469 0.92 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTHRAMEN1
SCHEMBL3618646 0.92 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTHRAMEN1
SCHEMBL810410 0.86 ALDH1A1 (0.52) ALDH1A1TSHRTHRBPOLBTDP1
SCHEMBL1140696 0.86 ALDH1A1 (0.58) ALDH1A1TSHRTHRBTHRATDP1
SCHEMBL177912 0.86 ALDH1A1 (0.58) ALDH1A1TSHRTHRBTHRAPOLB
SCHEMBL6278400 0.84 ALDH1A1 (0.55) ALDH1A1TSHRTHRBTHRATDP1
SCHEMBL3797757 0.84 ALDH1A1 (0.55) ALDH1A1TSHRTHRBTHRATDP1
SCHEMBL594419 0.84 ALDH1A1 (0.55) ALDH1A1TSHRTHRBTHRATDP1
SCHEMBL1140602 0.84 ALDH1A1 (0.55) ALDH1A1TSHRTHRBTHRATDP1

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 141 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112239394-B Method for preparing glycol by hydration of alkylene oxide and catalyst thereof 中国石油化工股份有限公司 2023-05-02 CN claimed
CN-111097554-B Strong alkaline carbon nano tube-graphene composite ion exchange resin material and preparation method thereof 中国石油化工股份有限公司 2023-05-02 CN claimed
CN-111097555-B Strong-alkaline graphene composite ion exchange resin material and preparation method thereof 中国石油化工股份有限公司 2023-04-07 CN claimed
CN-112239394-A Method for preparing glycol by hydrating alkylene oxide and catalyst thereof 中国石油化工股份有限公司 2021-01-19 CN claimed
CN-111097554-A Strong-alkaline carbon nanotube-graphene composite ion exchange resin material and preparation method thereof 中国石油化工股份有限公司 2020-05-05 CN claimed
CN-111100254-A Strong alkaline carbon nano tube composite ion exchange resin material and preparation method thereof 中国石油化工股份有限公司 2020-05-05 CN claimed
CN-111097555-A Strong-alkaline graphene composite ion exchange resin material and preparation method thereof 中国石油化工股份有限公司 2020-05-05 CN claimed
CN-106975516-B The preparation method of magnetic rodlike high temperature resistant phase transfer catalyst 西北工业大学 2019-06-04 CN claimed
CN-104926975-B Strong basicity composite resin material and preparation method thereof 中国石油化工股份有限公司 2018-07-17 CN claimed
CN-105367700-B Metallic graphite carbon alkene ion exchange resin material of strong basicity tri compound and preparation method thereof 中国石油化工股份有限公司 2018-02-13 CN claimed
CN-106975516-A The preparation method of the bar-shaped high temperature resistant phase transfer catalyst of magnetic 西北工业大学 2017-07-25 CN claimed
CN-104558360-B Strong basicity combination ion exchange resin material and preparation method thereof 中国石油化工股份有限公司 2017-06-20 CN claimed
CN-105367700-A Strong-basicity ternary composite metal-graphene-ion exchange resin material and preparing method thereof CHINA PETROLEUM & CHEM CORP 2016-03-02 CN claimed
CN-104926975-A Strong alkaline composite resin material and preparation method thereof CHINA PETROLEUM & CHEMICAL 2015-09-23 CN claimed
CN-104558359-A Preparation method of strong basic graphene composite resin material CHINA PETROLEUM & CHEMICAL 2015-04-29 CN claimed
CN-104558360-A Strong-alkalinity composite ion exchange resin material and preparation method thereof CHINA PETROLEUM & CHEMICAL 2015-04-29 CN claimed
CN-102372812-B Macroporous strong alkaline carbon nanotube composite ion exchange resin and preparation method thereof CHINA PETROLEUM & CHEMICAL 2013-03-06 CN claimed
CN-102372830-B Strongly basic carbon nanotube composite resin and its preparation method CHINA PETROLEUM & CHEMICAL 2012-11-28 CN claimed
CN-102372830-A Strongly basic carbon nanotube composite resin and its preparation method CHINA PETROLEUM & CHEMICAL 2012-03-14 CN claimed
CN-102372812-A Macroporous strong alkaline carbon nanotube composite ion exchange resin and preparation method thereof CHINA PETROLEUM & CHEMICAL 2012-03-14 CN claimed