SCHEMBL7317564

SCHEMBL7317564

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP2C19 P33261 1/20 0.39
CA2 P00918 1/20 0.37
TSHR P16473 2/20 0.35
ACHE P22303 1/20 0.34
HPGD P15428 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33
KISS1R Q969F8 2/20 0.32
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
CA1 P00915 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL14331893 0.85 TSHR (0.38) ALDH1A1TDP1CYP2C19CA2TSHR
SCHEMBL17213405 0.79 TSHR (0.39) ALDH1A1TDP1CYP2C19CA2TSHR
SCHEMBL9249004 0.78 AKR1B1 (0.36) HPGD
SCHEMBL20179605 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9618343 0.76 HIF1A (0.41) ALDH1A1TDP1TSHRHPGDLMNA
SCHEMBL16052588 0.76 CYP2C19 (0.39) ALDH1A1TDP1CYP2C19CA2TSHR
SCHEMBL20773673 0.76 PPARG (0.42) ALDH1A1TDP1CYP2C19CA2ACHE
SCHEMBL8962226 0.76
Propionaldehyde SCHEMBL28357120 0.75 TDP1 (0.47) ALDH1A1TDP1CYP2C19CA2ACHE
SCHEMBL3466462 0.75

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
EP-3016505-B1 PEPPER WITH NOVEL FLAVOR RIJK ZWAAN ZAADTEELT EN ZAADHANDEL BV (NL) 2023-03-22 EP disclosed
US-10219486-B2 Pepper with altered flavor attributes and odor intensity RIJK ZWAAN ZAADTEELT EN ZAADHANDEL B.V. (NL) 2019-03-05 US disclosed
US-20160160225-A1 PEPPER WITH NOVEL FLAVOR RIJK ZWAAN ZAADTEELT EN ZAADHANDEL B.V. (NL) 2016-06-09 US disclosed
EP-3016505-A1 PEPPER WITH NOVEL FLAVOR Rijk Zwaan Zaadteelt en Zaadhandel B.V. (NL) 2016-05-11 EP disclosed
WO-2015000993-A1 PEPPER WITH NOVEL FLAVOR RIJK ZWAAN ZAADTEELT EN ZAADHANDEL B.V. (NL) 2015-01-08 WO disclosed
EP-0292800-A2 Amino acid derivatives MERCK PATENT GmbH (DE) 1988-11-30 EP disclosed