SCHEMBL28597652

SCHEMBL28597652

CCCCC[C@@H]1C(=O)Oc2ccccc2[C@H]1CCCCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 1/20 0.44
PLA2G6 O60733 2/20 0.41
PLA2G4A P47712 1/20 0.41
GRM8 O00222 3/20 0.41
GRM1 Q13255 3/20 0.41
GRM7 Q14831 3/20 0.41
GRM4 Q14833 3/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GRM5 P41594 2/20 0.40
CES2 O00748 1/20 0.40
LYPLA1 O75608 1/20 0.40
LYPLA2 O95372 1/20 0.40
ABHD16A O95870 1/20 0.40
MIF P14174 1/20 0.40
USP2 O75604 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
SCHEMBL28596989 1.00 KMT2A (0.47) KMT2AMEN1MAPTPLA2G6PLA2G4A
SCHEMBL28596988 1.00 KMT2A (0.47) KMT2AMEN1MAPTPLA2G6PLA2G4A
SCHEMBL480910 0.84 KMT2A (0.47) KMT2AMEN1MAPTGRM8GRM1
SCHEMBL4592036 0.79 KMT2A (0.46) KMT2AMEN1MAPTGRM8GRM1
SCHEMBL23563177 0.77 PRKCA (0.47) TSHRLYPLA1LYPLA2ABHD16A
SCHEMBL14581339 0.77 PRKCA (0.47) TSHRLYPLA1LYPLA2ABHD16A
SCHEMBL6125509 0.76 KMT2A (0.51) KMT2AMEN1MAPTGRM8GRM1
Propionamide SCHEMBL28290130 0.76 GRM8 (0.48) KMT2AMEN1MAPTGRM8GRM1
Nonane SCHEMBL27663344 0.75 GAA (0.56) KMT2AMEN1MAPTGRM8GRM1
SCHEMBL10481361 0.75 KMT2A (0.44) KMT2AMEN1MAPTGRM8GRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113105422-B Preparation method of trans-3,4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2022-10-28 CN claimed
CN-113105422-A Preparation method of trans-3, 4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2021-07-13 CN claimed
CN-113105422-B Preparation method of trans-3,4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2022-10-28 CN disclosed
CN-113105422-B Preparation method of trans-3,4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2022-10-28 CN disclosed
CN-113105422-B Preparation method of trans-3,4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2022-10-28 CN disclosed
CN-113105422-A Preparation method of trans-3, 4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2021-07-13 CN disclosed
CN-113105422-A Preparation method of trans-3, 4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2021-07-13 CN disclosed
CN-113105422-A Preparation method of trans-3, 4-diaryl dihydrocoumarin compound 温州大学新材料与产业技术研究院 2021-07-13 CN disclosed