SCHEMBL8408445

SCHEMBL8408445

CCC1(CC)C(=O)OC(c2ccc3ccccc3c2)OC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.38
DRD2 P14416 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A2 P23975 4/20 0.36
SLC6A3 Q01959 4/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
GSK3B P49841 1/20 0.35
ADK P55263 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ELANE P08246 1/20 0.34

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
SCHEMBL3229576 0.80 ELANE (0.46) HTTKMT2ASMN1; SMN2ELANE
SCHEMBL8409441 0.80 SMN1; SMN2 (0.36) SLC6A4KDM4EMAPTMAPK1L3MBTL1
SCHEMBL8406468 0.79 ALDH1A1 (0.34) SLC6A4DRD2KDM4EMAPTL3MBTL1
SCHEMBL8408560 0.78 KDM4E (0.35) SLC6A4KDM4EMAPTMAPK1L3MBTL1
SCHEMBL8408559 0.77 HTR2C (0.31) SLC6A4KDM4EMAPTMAPK1L3MBTL1
SCHEMBL9246592 0.75 CDK1 (0.44) KDM4EGSK3B
SCHEMBL8104489 0.74 SIRT1 (0.40) KDM4EMAPTHTTKMT2ASMN1; SMN2
SCHEMBL8406335 0.73 ELANE (0.47) SLC6A4DRD2KDM4EMAPTMAPK1
SCHEMBL10053031 0.70 SLC6A4 (0.42) SLC6A4DRD2KDM4ESLC6A2SLC6A3
SCHEMBL11322478 0.67 SLC6A2 (0.38) SLC6A4DRD2KDM4ESLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663206-B1 Naphthalenmethylenemalonic diesters, and UV absorbers and cosmetic compositions containing the diesters KAO CORP (JP) 1999-07-14 EP disclosed
US-5508025-A SUNSCREEN AGENTS KAO CORPORATION (JP) 1996-04-16 US disclosed
EP-0663206-A1 Naphthalenmethylenemalonic diesters, and UV absorbers and cosmetic compositions containing the diesters Kao Corporation (JP) 1995-07-19 EP disclosed