SCHEMBL3908678

SCHEMBL3908678

CC(=O)CC(C)(O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.40
ALDH1A1 P00352 5/20 0.38
TDP1 Q9NUW8 2/20 0.38
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.31
TRPA1 O75762 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL19390249 0.80 ALDH1A1 (0.35) PIK3CDALDH1A1TDP1HMGCRCHRM1
SCHEMBL22965333 0.79 HMGCR (0.55) PIK3CDALDH1A1TDP1HMGCRCHRM1
SCHEMBL30794442 0.77 PIK3CD (0.39) PIK3CDALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL11161149 0.77 PIK3CD (0.39) PIK3CDALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL19036259 0.76 ALDH1A1 (0.39) PIK3CDALDH1A1TDP1HMGCRCHRM1
SCHEMBL12251197 0.76 ALDH1A1 (0.39) PIK3CDALDH1A1TDP1HMGCRCHRM1
SCHEMBL1782986 0.75 ALDH1A1 (0.40) ALDH1A1TDP1HMGCRCHRM1TBXA2R
Isopropyl Alcohol SCHEMBL9245512 0.74 PIK3CD (0.45) PIK3CDALDH1A1TDP1HMGCRCHRM1
Isopropyl Alcohol SCHEMBL4854365 0.74 PIK3CD (0.45) PIK3CDALDH1A1TDP1HMGCRCHRM1
SCHEMBL9066481 0.73 ALDH1A1 (0.39) ALDH1A1TDP1HMGCRCHRM1TBXA2R

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-102841504-B Positive photosensitive resin composition and method for forming pattern using the same CHI MEI CORP 2015-03-25 CN disclosed
US-20120328799-A1 POSITIVE PHOTOSENSITIVE RESIN COMPOSITION AND METHOD FOR FORMING PATTERNS BY USING THE SAME CHI MEI CORPORATION (TW) 2012-12-27 US disclosed
CN-102841504-A Positive photosensitive resin composition and method for forming pattern using the same CHI MEI CORP 2012-12-26 CN disclosed
CN-1584631-B Dye-containing resist composition and color filter using same NISSAN CHEMICAL IND LTD 2011-09-21 CN disclosed
US-7517619-B2 Dye-containing resist composition and color filter using same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-04-14 US disclosed
US-20050095530-A1 Dye-containing resist composition and color filter using same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-05-05 US disclosed
EP-1508835-A2 Dye-containing resist composition and color filter using same NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2005-02-23 EP disclosed
CN-1584631-A Dye-containing resist composition and color filter using same NISSAN CHEMICAL IND LTD (JP) 2005-02-23 CN disclosed