SCHEMBL31723013

SCHEMBL31723013

C[C@H](NC(=O)OCc1ccccc1)C(=O)OC1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.56
PREP P48147 2/20 0.55
MEN1 O00255 3/20 0.52
LMNA P02545 3/20 0.52
KMT2A Q03164 3/20 0.52
CTSK P43235 7/20 0.51
CYP3A4 P08684 6/20 0.51
TSHR P16473 6/20 0.51
CTSL P07711 3/20 0.51
CTSS P25774 3/20 0.51
CTSB P07858 1/20 0.51
CYP2C9 P11712 3/20 0.50
ALDH1A1 P00352 2/20 0.50
CYP2C19 P33261 2/20 0.50
ATM Q13315 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL28855000 0.99 CYP1A2 (0.55) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL607313 0.99 CYP1A2 (0.55) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL26276986 0.99 CYP1A2 (0.55) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL25407127 0.90 CYP1A2 (0.52) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL26276566 0.90 CYP1A2 (0.52) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL30089914 0.89 CYP1A2 (0.51) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL7107720 0.87 CYP1A2 (0.57) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL28854827 0.86 CYP1A2 (0.53) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL23818593 0.86 CYP1A2 (0.53) CYP1A2PREPMEN1LMNAKMT2A
SCHEMBL10609076 0.85 CYP1A2 (0.53) CYP1A2PREPMEN1LMNAKMT2A

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-4647435-A1 MODULATOR FOR PROMOTING BINDING OF BUTYROPHILIN 3A1/2A1 Unicet Biotech. LLC (CN) 2025-11-12 EP disclosed