SCHEMBL4359463

SCHEMBL4359463

CC(C)C(C)COC(=O)c1ccccc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.64
TSHR P16473 6/20 0.64
CYP3A4 P08684 2/20 0.48
CA2 P00918 1/20 0.48
ALOX15 P16050 1/20 0.47
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
ADRB2 P07550 3/20 0.43
ADRB1 P08588 3/20 0.43
ADRB3 P13945 3/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL30525847 1.00 ALDH1A1 (0.64) ALDH1A1TSHRCYP3A4CA2ALOX15
SCHEMBL2865757 0.93 TSHR (0.72) ALDH1A1TSHRCYP3A4CA2PRSS1
Phthalic Acid SCHEMBL29285130 0.86 ALDH1A1 (0.86) ALDH1A1TSHRCYP3A4CA2ALOX15
Phthalic Acid SCHEMBL29007201 0.86 ALDH1A1 (0.86) ALDH1A1TSHRCYP3A4CA2ALOX15
SCHEMBL226501 0.86 ALDH1A1 (0.86) ALDH1A1TSHRCYP3A4CA2ALOX15
SCHEMBL29601593 0.86 ALDH1A1 (0.86) ALDH1A1TSHRCYP3A4CA2ALOX15
Phthalic Acid SCHEMBL19667985 0.86 ALDH1A1 (0.86) ALDH1A1TSHRCYP3A4CA2ALOX15
Phthalic Acid SCHEMBL27873885 0.86 ALDH1A1 (0.86) ALDH1A1TSHRCYP3A4CA2ALOX15
SCHEMBL6831503 0.85 ALDH1A1 (0.66) ALDH1A1TSHRCYP3A4CA2ALOX15
SCHEMBL4597929 0.85 ALDH1A1 (0.66) ALDH1A1TSHRCYP3A4CA2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116199995-A High-fluidity polypropylene resin composition and molded article made from the same 韩华道达尔能源有限公司 2023-06-02 CN claimed
US-7619048-B2 Method for producing propylene polymer using alkoxysilane compound containing trialkysilyl group in molecular structure SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2009-11-17 US claimed
CN-111349185-B Solid catalyst for propylene polymerization and method for producing block copolymer using the same 韩华道达尔能源有限公司 2023-02-03 CN disclosed
CN-108148153-B Solid catalyst and method for preparing propylene polymer or copolymer using the same 韩华道达尔有限公司 2021-08-10 CN disclosed
CN-111349185-A Solid catalyst for propylene polymerization and method for producing block copolymer using the same 韩华道达尔有限公司 2020-06-30 CN disclosed
EP-1092730-A1 PROCESS FOR PRODUCING OLEFIN POLYMER AND OLEFIN POLYMER Mitsui Chemicals, Inc. (JP) 2001-04-18 EP disclosed