SCHEMBL29644411

SCHEMBL29644411

NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.52
ACE P12821 5/20 0.51
CPA1 P15085 1/20 0.51
ACE2 Q9BYF1 1/20 0.51
FOLH1 Q04609 1/20 0.49
NAALAD2 Q9Y3Q0 1/20 0.49
ENPEP Q07075 2/20 0.48
QRFPR Q96P65 1/20 0.48
CHRNA1 P02708 1/20 0.47
CHRNG P07510 1/20 0.47
CHRNB1 P11230 1/20 0.47
CHRND Q07001 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
OPRM1 P35372 1/20 0.47
OPRD1 P41143 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
SCHEMBL30367266 0.96 ENPEP (0.52) MMEACECPA1ACE2FOLH1
SCHEMBL29822475 0.95 MME (0.56) MMEACECPA1ACE2FOLH1
SCHEMBL13588078 0.91 MME (0.63) MMEACECHRNA1CHRNGCHRNB1
SCHEMBL29602654 0.91 MME (0.63) MMEACECHRNA1CHRNGCHRNB1
SCHEMBL29350849 0.91 MME (0.63) MMEACECHRNA1CHRNGCHRNB1
SCHEMBL29603463 0.91 MME (0.63) MMEACECHRNA1CHRNGCHRNB1
SCHEMBL30416809 0.90 ACE (0.53) MMEACECPA1ACE2FOLH1
SCHEMBL4257186 0.89 OPRD1 (0.50) MMEACECPA1ACE2FOLH1
SCHEMBL4257177 0.89 OPRD1 (0.50) MMEACECPA1ACE2FOLH1
SCHEMBL479126 0.89 ACE (0.60) MMEACECPA1ACE2FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220289846-A1 ANTIBODIES TO HUMAN PROGRAMMED DEATH RECEPTOR PD-1 ZYDUS LIFESCIENCES LIMITED (IN) 2022-09-15 US claimed
US-12516121-B2 Antibodies to human programmed death receptor PD-1 ZYDUS LIFESCIENCES LIMITED (IN) 2026-01-06 US disclosed
US-20220289846-A1 ANTIBODIES TO HUMAN PROGRAMMED DEATH RECEPTOR PD-1 ZYDUS LIFESCIENCES LIMITED (IN) 2022-09-15 US disclosed
EP-3997126-A1 ANTIBODIES TO HUMAN PROGRAMMED DEATH RECEPTOR PD-1 Cadila Healthcare Limited (IN) 2022-05-18 EP disclosed