SCHEMBL8375820

SCHEMBL8375820

CCOC(=O)C=Cc1ccc(F)cc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
CYP3A4 P08684 1/20 0.50
TTR P02766 1/20 0.49
DPP4 P27487 1/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
ESR1 P03372 1/20 0.48
CYP1A1 P04798 1/20 0.48
CYP1B1 Q16678 1/20 0.48
IDO1 P14902 1/20 0.47
TDO2 P48775 1/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
NFE2L2 Q16236 3/20 0.46

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
SCHEMBL8375818 1.00 POLB (0.56) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL2325697 0.89 CYP3A4 (0.51) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL2325706 0.89 CYP3A4 (0.51) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL31390627 0.89 CYP3A4 (0.51) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL3501821 0.88 CYP3A4 (0.54) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL4514546 0.88 ESR1 (0.57) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL4514544 0.88 ESR1 (0.57) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL13678677 0.88 ESR1 (0.57) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL30235603 0.88 ESR1 (0.57) POLBMAPTRAB9ACYP3A4TTR
SCHEMBL13311781 0.88 CYP3A4 (0.54) POLBMAPTRAB9ACYP3A4TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108864375-B Preparation method of water-retention and mud-resistance type polycarboxylate superplasticizer 科之杰新材料集团有限公司 2021-05-25 CN claimed
CN-108864375-A A kind of preparation method being retained anti-chamotte mould polycarboxylate water-reducer 科之杰新材料集团有限公司 2018-11-23 CN claimed
CN-108864374-A A kind of preparation method of the high water-retaining type polycarboxylate water-reducer of ethers 科之杰新材料集团有限公司 2018-11-23 CN claimed
CN-108864375-B Preparation method of water-retention and mud-resistance type polycarboxylate superplasticizer 科之杰新材料集团有限公司 2021-05-25 CN disclosed
CN-108864374-B Preparation method of ether high-water-retention polycarboxylate superplasticizer 科之杰新材料集团有限公司 2021-05-25 CN disclosed
CN-108864374-A A kind of preparation method of the high water-retaining type polycarboxylate water-reducer of ethers 科之杰新材料集团有限公司 2018-11-23 CN disclosed
CN-108864375-A A kind of preparation method being retained anti-chamotte mould polycarboxylate water-reducer 科之杰新材料集团有限公司 2018-11-23 CN disclosed
US-6005116-A HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA SANKYO COMPANY, LIMITED (JP) 1999-12-21 US disclosed
EP-0885891-A1 ISOXAZOLE DERIVATIVES SANKYO COMPANY LIMITED (JP) 1998-12-23 EP disclosed
EP-0401166-B1 Nitrogen-containing titanocenes and their use CIBA GEIGY AG (CH) 1995-02-22 EP disclosed
US-5068371-A Photoinitiators for polymerization CIBA-GEIGY CORPORATION (US) 1991-11-26 US disclosed
EP-0401166-A2 Nitrogen-containing titanocenes and their use CIBA-GEIGY AG (CH) 1990-12-05 EP disclosed