SCHEMBL28066767

SCHEMBL28066767

C=C(C)C(=O)OCCCOP(=O)(O)OCCCC

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
THRB P10828 1/20 0.46
ALDH1A1 P00352 1/20 0.44
P2RY10 O00398 7/20 0.44
GPR34 Q9UPC5 3/20 0.44
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 1/20 0.41
LPAR3 Q9UBY5 3/20 0.41
LPAR1 Q92633 2/20 0.41
LPAR2 Q9HBW0 2/20 0.41
HPGD P15428 1/20 0.40

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
SCHEMBL28240285 0.98 TSHR (0.60) TSHRTHRBALDH1A1P2RY10GPR34
SCHEMBL28347910 0.95 TSHR (0.70) TSHRTHRBP2RY10GPR34POLB
SCHEMBL28239280 0.94 TSHR (0.68) TSHRTHRBP2RY10GPR34POLB
SCHEMBL27682837 0.94 TSHR (0.73) TSHRTHRBP2RY10GPR34POLB
SCHEMBL28276961 0.94 TSHR (0.73) TSHRTHRBP2RY10GPR34POLB
SCHEMBL27399189 0.94 TSHR (0.73) TSHRTHRBP2RY10GPR34POLB
SCHEMBL28110717 0.94 TSHR (0.57) TSHRTHRBALDH1A1P2RY10GPR34
SCHEMBL28264929 0.94 TSHR (0.57) TSHRTHRBALDH1A1P2RY10GPR34
SCHEMBL15412 0.93 TSHR (0.55) TSHRTHRBALDH1A1P2RY10GPR34
SCHEMBL28239275 0.92 TSHR (0.71) TSHRTHRBP2RY10GPR34POLB

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-105601827-B A kind of preparation method of the cement water reducing agent with superelevation water-reducing property 江苏苏博特新材料股份有限公司 2018-01-02 CN claimed
CN-105622853-A Preparing method of mud-blocking type water reducing agent JIANGSU SUBOTE NEW MAT CO LTD 2016-06-01 CN claimed
CN-105601826-A Method for preparing viscosity reduction type water reduction agent JIANGSU SUBOTE NEW MAT CO LTD 2016-05-25 CN claimed
CN-105601827-A Preparation method for concrete water reducer with ultrahigh water reducing performance JIANGSU SOBUTE NEW MAT CO LTD 2016-05-25 CN claimed
CN-105601827-B A kind of preparation method of the cement water reducing agent with superelevation water-reducing property 江苏苏博特新材料股份有限公司 2018-01-02 CN disclosed
CN-105601826-B A kind of preparation method of viscosity reduction type water reducer 江苏苏博特新材料股份有限公司 2018-01-02 CN disclosed
CN-105622853-B A kind of preparation method for hindering chamotte mould water reducer 江苏苏博特新材料股份有限公司 2017-11-24 CN disclosed
CN-105622853-A Preparing method of mud-blocking type water reducing agent JIANGSU SUBOTE NEW MAT CO LTD 2016-06-01 CN disclosed
CN-105601826-A Method for preparing viscosity reduction type water reduction agent JIANGSU SUBOTE NEW MAT CO LTD 2016-05-25 CN disclosed
CN-105601827-A Preparation method for concrete water reducer with ultrahigh water reducing performance JIANGSU SOBUTE NEW MAT CO LTD 2016-05-25 CN disclosed