SCHEMBL28544322

SCHEMBL28544322

COC(=O)CCC1CCCC1N

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
EPHX2 P34913 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 3/20 0.33
MEN1 O00255 1/20 0.33
HDAC8 Q9BY41 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
HDAC1 Q13547 1/20 0.33
CA12 O43570 1/20 0.32
CA14 Q9ULX7 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL29069431 0.96 EPHX2 (0.41) TSHREPHX2SMN1; SMN2LMNAKDM4E
SCHEMBL6639313 0.96 EPHX2 (0.41) TSHREPHX2SMN1; SMN2LMNAKDM4E
SCHEMBL6643947 0.96 EPHX2 (0.41) TSHREPHX2SMN1; SMN2LMNAKDM4E
Hydrochloric Acid SCHEMBL6641396 0.95 EPHX2 (0.41) TSHREPHX2SMN1; SMN2LMNAKDM4E
Hydrochloric Acid SCHEMBL6644945 0.95 EPHX2 (0.41) TSHREPHX2SMN1; SMN2LMNAKDM4E
Hydrochloric Acid SCHEMBL6643943 0.95 EPHX2 (0.41) TSHREPHX2SMN1; SMN2LMNAKDM4E
SCHEMBL16060999 0.81 TSHR (0.48) TSHREPHX2SMN1; SMN2LMNAKDM4E
SCHEMBL23666088 0.80 TSHR (0.43) TSHREPHX2SMN1; SMN2LMNAKDM4E
SCHEMBL4490867 0.77 TSHR (0.40) TSHREPHX2SMN1; SMN2
SCHEMBL31369974 0.77 SLC6A12 (0.40) TSHRLMNAKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112708053-B Ester viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团有限公司 2023-02-28 CN claimed
CN-112708056-B Viscosity-reducing polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2022-10-18 CN claimed
CN-112708052-A Ether viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团(贵州)有限公司 2021-04-27 CN claimed
CN-112708056-A Viscosity-reducing polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2021-04-27 CN claimed
CN-112708055-A Ester ether copolymerization viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团(贵州)有限公司 2021-04-27 CN claimed
CN-112708054-A Polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2021-04-27 CN claimed
CN-112708053-A Ester viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团有限公司 2021-04-27 CN claimed
CN-112708053-B Ester viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团有限公司 2023-02-28 CN disclosed
CN-112708052-B Ether viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团(贵州)有限公司 2022-10-25 CN disclosed
CN-112708056-B Viscosity-reducing polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2022-10-18 CN disclosed
CN-112708054-B Polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2022-10-18 CN disclosed
CN-112708052-A Ether viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团(贵州)有限公司 2021-04-27 CN disclosed
CN-112708056-A Viscosity-reducing polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2021-04-27 CN disclosed
CN-112708055-A Ester ether copolymerization viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团(贵州)有限公司 2021-04-27 CN disclosed
CN-112708054-A Polycarboxylate superplasticizer for concrete member and preparation method thereof 科之杰新材料集团河南有限公司 2021-04-27 CN disclosed
CN-112708053-A Ester viscosity-reducing hydration regulator and preparation method thereof 科之杰新材料集团有限公司 2021-04-27 CN disclosed