SCHEMBL31268356

SCHEMBL31268356

N[C@@H](CCCCNC(=O)c1ccncc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.61
CYP2C19 P33261 2/20 0.61
CYP2C9 P11712 1/20 0.61
NAAA Q02083 1/20 0.58
EPHX2 P34913 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.53
TSHR P16473 1/20 0.53
RAB9A P51151 1/20 0.51
ALDH1A1 P00352 1/20 0.51
FOLH1 Q04609 1/20 0.51
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC1 Q13547 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MPO P05164 1/20 0.47
CYP3A4 P08684 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2A6 P11509 1/20 0.47

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
SCHEMBL2239991 0.96 CYP1A2 (0.58) CYP1A2CYP2C19CYP2C9NAAAEPHX2
SCHEMBL2239985 0.96 CYP1A2 (0.58) CYP1A2CYP2C19CYP2C9NAAAEPHX2
SCHEMBL1769566 0.90 EPHX2 (0.64) CYP1A2CYP2C19CYP2C9NAAAEPHX2
SCHEMBL1769567 0.90 EPHX2 (0.64) CYP1A2CYP2C19CYP2C9NAAAEPHX2
SCHEMBL24130547 0.87 HDAC1 (0.58) NAAAEPHX2RAB9AALDH1A1NPC1
SCHEMBL345305 0.87 HDAC1 (0.58) NAAAEPHX2RAB9AALDH1A1NPC1
SCHEMBL1242961 0.87 HDAC1 (0.58) NAAAEPHX2RAB9AALDH1A1NPC1
SCHEMBL458071 0.84 EPHX2 (0.65) CYP1A2CYP2C19CYP2C9EPHX2RAB9A
SCHEMBL2235416 0.84 EPHX2 (0.65) CYP1A2CYP2C19CYP2C9EPHX2RAB9A
SCHEMBL30658134 0.84 EPHX2 (0.65) CYP1A2CYP2C19CYP2C9EPHX2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720087-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR Zealand Pharma A/S (DK) 2026-04-08 EP disclosed
WO-2024246269-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR ZEALAND PHARMA A/S (DK) 2024-12-05 WO disclosed
EP-4471048-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR Zealand Pharma A/S (DK) 2024-12-04 EP disclosed