SCHEMBL31253374

SCHEMBL31253374

CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 8/20 0.58
▸ KDM4E B2RXH2 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ MPO P05164 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ PMP22 Q01453 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ ACE P12821 1/20 0.52
▸ UTS2R Q9UKP6 1/20 0.52
▸ ECE1 P42892 1/20 0.52
▸ MAGI3 Q5TCQ9 1/20 0.51

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
SCHEMBL29754403 0.94 GHSR (0.57) GHSRKDM4EMEN1LMNAMPO
SCHEMBL30490002 0.93 GHSR (0.66) GHSR
SCHEMBL30490007 0.93 GHSR (0.66) GHSR
SCHEMBL30130571 0.93 GHSR (0.59) GHSRACEUTS2RECE1
SCHEMBL30130563 0.93 GHSR (0.59) GHSRACEUTS2RECE1
SCHEMBL29496496 0.93 GHSR (0.56) GHSRKDM4EMEN1LMNAMPO
SCHEMBL30093048 0.92 GHSR (0.60) GHSRACEECE1
SCHEMBL30898976 0.92 ACE (0.55) GHSRACEUTS2RECE1
SCHEMBL31632618 0.92 ACE (0.55) GHSRACEUTS2RECE1
SCHEMBL31619559 0.91 GHSR (0.61) GHSRUTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119080883-A Antibacterial peptide and application thereof 合肥科生景肽生物科技有限公司 2024-12-06 — — CN claimed
CN-119080883-A Antibacterial peptide and application thereof 合肥科生景肽生物科技有限公司 2024-12-06 — — CN disclosed
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