SCHEMBL8028307

SCHEMBL8028307

C=COC(=O)C12CCC(CC1)C2

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL5374123 0.80 MAPT (0.44) ALDH1A1NPSR1KMT2A
SCHEMBL19506897 0.80 NPSR1 (0.33) NPSR1KMT2A
SCHEMBL2515948 0.77 ALDH1A1 (0.38) ALDH1A1HTTNPSR1KMT2A
SCHEMBL1464077 0.77 NPSR1 (0.45) ALDH1A1NPSR1KMT2A
SCHEMBL16930391 0.77 KMT2A (0.31) ALDH1A1HTTNPSR1KMT2A
SCHEMBL7600486 0.75 ALDH1A1 (0.37) ALDH1A1HTTNPSR1KMT2A
Acetic Acid SCHEMBL27569637 0.74 SCN1A (0.41) ALDH1A1NPSR1KMT2A
Ethylene Glycol SCHEMBL15398368 0.74 PRKCA (0.44) ALDH1A1NPSR1KMT2A
SCHEMBL1699800 0.74 ALDH1A1 (0.36) ALDH1A1HTTNPSR1KMT2A
SCHEMBL11884387 0.74 NPSR1 (0.36) ALDH1A1HTTNPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4190687-A WITH COPOLYMER OF ETHYLENEICALLY UNSATURATED ESTER AND ETHYLENICALLY UNSATURATED HYDROCARBON TO PREVENT COLOR BLEEDING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-02-26 US claimed
US-4000958-A Method for treating leather SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-01-04 US claimed
US-6162864-A Polyvinyl alcohol KURARAY CO., LTD. (JP) 2000-12-19 US disclosed
EP-0716098-B1 Wound dressing KURARAY CO (JP) 1999-03-17 EP disclosed
US-5880216-A WOUND DRESSING MATERIAL COMPRISING GEL PRODUCED FROM SAPONIFIED VINYL ESTER POLYMER WHICH HAS BEEN FURTHER MODIFIED WITH POLAR GROUP KURARAY CO., LTD. (JP) 1999-03-09 US disclosed
US-5679371-A A VINYL ALCOHOL POLYMER HYDROGEL CONTAINING VINYL ESTER UNITS KURARAY CO., LTD. (JP) 1997-10-21 US disclosed
US-5661101-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1997-08-26 US disclosed
EP-0780407-A2 Polyvinyl alcohol and gel therefrom KURARAY CO., LTD. (JP) 1997-06-25 EP disclosed
EP-0716098-A2 Wound dressing KURARAY CO., LTD. (JP) 1996-06-12 EP disclosed
US-4190687-A WITH COPOLYMER OF ETHYLENEICALLY UNSATURATED ESTER AND ETHYLENICALLY UNSATURATED HYDROCARBON TO PREVENT COLOR BLEEDING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-02-26 US disclosed
US-4000958-A Method for treating leather SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-01-04 US disclosed