SCHEMBL23280345

SCHEMBL23280345

O=C(O)C1=CCC(C(=O)N2CCCCC2)C=C1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.38
ALDH1A1 P00352 4/20 0.34
NPC1 O15118 1/20 0.34
GNE Q9Y223 1/20 0.33
HSD11B1 P28845 1/20 0.33
TSHR P16473 2/20 0.33
SIGMAR1 Q99720 1/20 0.33
LYPLA2 O95372 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ABCB1 P08183 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL23095872 0.85 ALDH1A1 (0.40) HPGDALDH1A1TSHRMEN1KMT2A
SCHEMBL19114768 0.78 HPGD (0.36) HPGDALDH1A1NPC1TSHRMEN1
SCHEMBL23048514 0.76 GABRR1 (0.31)
SCHEMBL1353549 0.76 GABRR1 (0.31)
SCHEMBL2535844 0.73 HPGD (0.54) HPGDALDH1A1HSD11B1TSHRLMNA
SCHEMBL13726019 0.72 PREP (0.32) HPGDL3MBTL1
SCHEMBL2541166 0.71 HPGD (0.50) HPGDALDH1A1HSD11B1TSHRLMNA
SCHEMBL2531710 0.69
SCHEMBL14003433 0.66 HRH3 (0.43)
SCHEMBL13620759 0.65 GABRR1 (0.31)

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-3189041-B1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2021-04-28 EP disclosed