SCHEMBL29255772

SCHEMBL29255772

CCCCCCC1CC1COC(=O)CCC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.58
DGKA P23743 1/20 0.44
LPAR1 Q92633 3/20 0.43
LPAR3 Q9UBY5 3/20 0.43
HPSE Q9Y251 1/20 0.43
PAM P19021 2/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ENPP2 Q13822 2/20 0.40
NLRP3 Q96P20 1/20 0.40
TSHR P16473 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL16174232 0.94 ALOX5 (0.58) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL10086062 0.94 ALOX5 (0.58) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL19633081 0.89 ALOX5 (0.54) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL18356005 0.84 ALOX5 (0.49) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL18995461 0.84 ALOX5 (0.49) ALOX5DGKALPAR1LPAR3PAM
SCHEMBL19633080 0.84 TBXA2R (0.49) ALOX5DGKALPAR1LPAR3ALDH1A1
SCHEMBL10081244 0.84 ALOX5 (0.49) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL29255906 0.84 ALOX5 (0.55) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL24711371 0.82 DGKA (0.70) ALOX5DGKALPAR1LPAR3HPSE
SCHEMBL24711102 0.82 DGKA (0.70) ALOX5DGKALPAR1LPAR3HPSE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118317944-A Acyclic lipids and methods of use thereof 雷纳嘉德医疗管理公司 2024-07-09 CN disclosed