SCHEMBL10743217

SCHEMBL10743217

NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ QRFPR Q96P65 4/20 0.45
▸ CTSB P07858 2/20 0.43
▸ HRH1 P35367 3/20 0.43
▸ KISS1R Q969F8 1/20 0.42
▸ KEAP1 Q14145 1/20 0.42
▸ CCKBR P32239 5/20 0.41

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
SCHEMBL10746759 0.99 QRFPR (0.46) QRFPRCTSBHRH1KISS1RKEAP1
SCHEMBL10740214 0.91 HDAC3 (0.46) QRFPRCTSBKISS1RKEAP1
SCHEMBL10741543 0.86 SMN1; SMN2 (0.35) CTSBKEAP1
SCHEMBL10743964 0.84 TFPI (0.51) KEAP1
SCHEMBL10741300 0.84 TFPI (0.51) KISS1RCCKBR
SCHEMBL10745661 0.81 APC (0.49) QRFPRKISS1RCCKBR
SCHEMBL9651713 0.81 CCKBR (0.45) CCKBR
SCHEMBL9818612 0.80 LMNA (0.46) —
SCHEMBL9653492 0.80 LMNA (0.46) —
SCHEMBL10742699 0.78 QRFPR (0.51) QRFPRKISS1R

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-4711952-A IMMUNOSTIMULATIVE, OR IMMUNOSUPPRESSORY AGENTS SPOFA, SPOJENE PODNIKY PRO ZDRAVOTNICKOUVYROBU (CS) 1987-12-08 — — US claimed
EP-0232435-A2 Serum thymic factor peptide analogs and a process for the preparation thereof SPOFA Spojené Podniky Pro Zdravotnickou Vyrobu (CS) 1987-08-19 — — EP claimed
US-4711952-A IMMUNOSTIMULATIVE, OR IMMUNOSUPPRESSORY AGENTS SPOFA, SPOJENE PODNIKY PRO ZDRAVOTNICKOUVYROBU (CS) 1987-12-08 — — US disclosed
EP-0232435-A2 Serum thymic factor peptide analogs and a process for the preparation thereof SPOFA Spojené Podniky Pro Zdravotnickou Vyrobu (CS) 1987-08-19 — — EP disclosed
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