SCHEMBL10741300

SCHEMBL10741300

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

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.51
▸ OPRL1 P41146 9/20 0.51
▸ BCL2L1 Q07817 1/20 0.48
▸ CCKBR P32239 1/20 0.45
▸ KISS1R Q969F8 1/20 0.45

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
SCHEMBL10743964 0.97 TFPI (0.51) TFPIOPRL1BCL2L1
SCHEMBL10745661 0.91 APC (0.49) TFPIOPRL1CCKBRKISS1R
SCHEMBL10744274 0.90 OPRL1 (0.42) TFPIOPRL1
Nonathymulin SCHEMBL2109423 0.90 OPRL1 (0.42) TFPIOPRL1
Nonathymulin SCHEMBL29727660 0.90 OPRL1 (0.42) TFPIOPRL1
SCHEMBL29727699 0.87 OPRL1 (0.43) TFPIOPRL1BCL2L1
SCHEMBL10747193 0.86 OPRL1 (0.55) TFPIOPRL1KISS1R
SCHEMBL10747201 0.86 OPRL1 (0.55) TFPIOPRL1KISS1R
SCHEMBL10743217 0.84 QRFPR (0.45) CCKBRKISS1R
SCHEMBL10746759 0.84 QRFPR (0.46) CCKBRKISS1R

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 3 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
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