SCHEMBL23833698

SCHEMBL23833698

O=C(O)C(CCCCCC1CCCCC1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.48
KDM5A P29375 3/20 0.47
PHF8 Q9UPP1 3/20 0.47
KDM2A Q9Y2K7 3/20 0.47
KDM4C Q9H3R0 2/20 0.47
KDM4A O75164 1/20 0.47
EPHX1 P07099 1/20 0.42
CYP1A2 P05177 1/20 0.42
NAAA Q02083 2/20 0.41
METAP1 P53582 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
HPGD P15428 1/20 0.38

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
SCHEMBL8330846 0.92 CYP1A2 (0.45) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL11223456 0.92 CYP1A2 (0.45) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL16732010 0.90 MAPT (0.42) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL16432905 0.85 GPR84 (0.48) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL6295047 0.85 GPR84 (0.48) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL2854426 0.85 GRIN2D (0.38) KDM5APHF8KDM2AKDM4CKDM4A
SCHEMBL2857134 0.85 GRIN2D (0.38) KDM5APHF8KDM2AKDM4CKDM4A
SCHEMBL11023880 0.84 METAP2 (0.44) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL11024609 0.84 METAP2 (0.44) SIGMAR1KDM5APHF8KDM2AKDM4C
SCHEMBL11020226 0.84 METAP2 (0.44) SIGMAR1KDM5APHF8KDM2AKDM4C

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
EP-4121408-A1 SYNTHESIS OF CAPSAICIN DERIVATIVES Axichem AB (NO) 2023-01-25 EP disclosed
WO-2021187992-A1 SYNTHESIS OF CAPSAICIN DERIVATIVES AXICHEM AS (NO) 2021-09-23 WO disclosed