SCHEMBL29211196

SCHEMBL29211196

CCCC(=O)Cc1ccco1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
RIPK1 Q13546 1/20 0.43
ALOX5 P09917 1/20 0.42
HPGD P15428 4/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 2/20 0.41
PTPN7 P35236 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL14680370 0.89 ALDH1A1 (0.45) ALDH1A1RIPK1ALOX5HPGDMAPT
SCHEMBL25259291 0.86 GAA (0.47) ALDH1A1HPGDMAPTPOLBSMN1; SMN2
SCHEMBL25273425 0.86 GAA (0.47) ALDH1A1HPGDMAPTPOLBSMN1; SMN2
SCHEMBL25262746 0.86 GAA (0.47) ALDH1A1HPGDMAPTPOLBSMN1; SMN2
SCHEMBL25258554 0.86 GAA (0.47) ALDH1A1HPGDMAPTPOLBSMN1; SMN2
SCHEMBL25260601 0.86 GAA (0.47) ALDH1A1HPGDMAPTPOLBSMN1; SMN2
SCHEMBL11329486 0.85 ALDH1A1 (0.50) ALDH1A1RIPK1ALOX5HPGDMAPT
SCHEMBL7087548 0.84 ALDH1A1 (0.52) ALDH1A1ALOX5HPGDMAPTKDM4E
SCHEMBL15694293 0.84 ALDH1A1 (0.50) ALDH1A1RIPK1ALOX5HPGDMAPT
SCHEMBL7730594 0.83 ALDH1A1 (0.38) ALDH1A1HPGDMAPTKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119894387-A Flavor modulating composition 玉米产品开发公司 2025-04-25 CN disclosed
CN-117835831-A Flavor modulating composition 玉米产品开发公司 2024-04-05 CN disclosed