SCHEMBL29295587

SCHEMBL29295587

CCCC(=O)NCCOCCOCCOCCOCCC(=O)NC(C=O)CCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.41
▸ FOLH1 Q04609 2/20 0.35
▸ PLA2G10 O15496 1/20 0.34
▸ SELP P16109 1/20 0.34
▸ PLA2G2C Q5R387 2/20 0.34
▸ CASP2 P42575 1/20 0.34
▸ CTSK P43235 3/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL12324725 0.83 PLA2G2C (0.45) FOLH1PLA2G10PLA2G2CCTSK
SCHEMBL12295313 0.81 GLP1R (0.59) GLP1RPLA2G10PLA2G2CMEN1KMT2A
SCHEMBL12295886 0.81 GLP1R (0.59) GLP1RPLA2G10PLA2G2CMEN1KMT2A
SCHEMBL12296713 0.81 GLP1R (0.59) GLP1RPLA2G10PLA2G2CMEN1KMT2A
SCHEMBL16478853 0.81 GLP1R (0.45) GLP1RPLA2G10PLA2G2C
SCHEMBL12296113 0.80 GLP1R (0.58) GLP1RPLA2G10PLA2G2C
SCHEMBL30063936 0.80 CASP2 (0.44) GLP1RCASP2MEN1KMT2A
SCHEMBL30940194 0.80 CASP2 (0.47) GLP1RCASP2MEN1KMT2A
SCHEMBL29832716 0.80 CASP2 (0.47) GLP1RCASP2MEN1KMT2A
SCHEMBL24798437 0.79 FOLH1 (0.33) FOLH1SELPPLA2G2CMEN1KMT2A

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
EP-3883926-B1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDE DERIVATIVES AND PROTEIN CONJUGATES THEREOF FOR USE AS LXR AGONISTS REGENERON PHARMA (US) 2024-07-10 — — EP disclosed
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