SCHEMBL30617832

SCHEMBL30617832

NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CN)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ QRFPR Q96P65 7/20 0.57
▸ FOLH1 Q04609 5/20 0.51
▸ CALCRL Q16602 1/20 0.49
▸ OPRL1 P41146 3/20 0.47
▸ APC P25054 1/20 0.47
▸ TFPI P10646 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
SCHEMBL29664477 0.89 NAALAD2 (0.53) QRFPRFOLH1APC
SCHEMBL30900769 0.86 SLC15A2 (0.58) QRFPRCALCRL
SCHEMBL31138053 0.85 MMP2 (0.54) FOLH1CALCRL
SCHEMBL30974414 0.85 OPRD1 (0.53) APCTFPI
SCHEMBL31480024 0.84 OPRL1 (0.63) OPRL1TFPI
SCHEMBL30397713 0.84 OPRM1 (0.53) FOLH1
SCHEMBL29601799 0.84 NMT1 (0.51) QRFPRFOLH1OPRL1TFPI
SCHEMBL29616823 0.84 NMT1 (0.51) QRFPRFOLH1OPRL1TFPI
SCHEMBL29939679 0.83 APC (0.55) QRFPRAPC
SCHEMBL29504883 0.83 NAALAD2 (0.55) QRFPR

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
CN-116802203-A Cells expressing chimeric receptors from modified constant CD3 immunoglobulin superfamily chain loci, related polynucleotides and methods 朱诺治疗学股份有限公司 2023-09-22 — — CN disclosed
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