SCHEMBL31578751

SCHEMBL31578751

COC(=O)CCCCCCCCC(C#N)(CCCCCCCCC(=O)OC)S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.39
KMT2A Q03164 3/20 0.39
RAB9A P51151 1/20 0.39
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 3/20 0.37
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.35
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL31578916 0.89 L3MBTL1 (0.40) ALDH1A1KMT2ARAB9ACYP3A4HTT
SCHEMBL26710918 0.84 PPARA (0.36) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19
SCHEMBL26123732 0.79 CYP4F2 (0.47) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19
SCHEMBL31108833 0.79 CYP4F2 (0.47) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19
SCHEMBL31108856 0.79 CYP4F2 (0.47) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19
SCHEMBL31108871 0.79 CYP4F2 (0.47) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19
SCHEMBL31578797 0.78 ALDH1A1 (0.39) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19
SCHEMBL26711231 0.78 HSD11B1 (0.38) ALDH1A1KMT2AHTTLMNAMAPT
SCHEMBL26711437 0.78 L3MBTL1 (0.36) ALDH1A1KMT2ARAB9AHTTLMNA
SCHEMBL31578989 0.77 ALDH1A1 (0.40) ALDH1A1KMT2ARAB9ACYP3A4CYP2C19

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
WO-2025104695-A1 IONIZABLE CATIONIC LIPIDS AND LIPID NANOPARTICLES THEREOF Corti Therapeutics Pte. Ltd. (SG) 2025-05-22 WO disclosed