SCHEMBL10745622

SCHEMBL10745622

C[C@H](N)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)NCC(N)=O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NMT1 P30419 5/20 0.51
▸ NMT2 O60551 4/20 0.51
▸ TLR2 O60603 1/20 0.45
▸ OPRL1 P41146 6/20 0.45
▸ GRIN2D O15399 1/20 0.42
▸ GRIN3B O60391 1/20 0.42
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ GRIN2C Q14957 1/20 0.42
▸ GRIN3A Q8TCU5 1/20 0.42
▸ TFPI P10646 1/20 0.42

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
SCHEMBL10745610 1.00 NMT1 (0.51) NMT1NMT2TLR2OPRL1GRIN2D
SCHEMBL10740541 0.94 NMT1 (0.50) NMT1NMT2TLR2OPRL1GRIN2D
SCHEMBL10740555 0.94 NMT1 (0.50) NMT1NMT2TLR2OPRL1GRIN2D
SCHEMBL29769744 0.88 NMT1 (0.54) NMT1NMT2TLR2OPRL1GRIN2D
Trifluoroacetic Acid SCHEMBL10742132 0.88 OPRL1 (0.46) NMT1NMT2TLR2OPRL1GRIN2D
SCHEMBL10747193 0.87 OPRL1 (0.55) OPRL1TFPI
SCHEMBL10747201 0.87 OPRL1 (0.55) OPRL1TFPI
SCHEMBL10744155 0.84 OPRL1 (0.55) OPRL1TFPI
SCHEMBL10744135 0.84 OPRL1 (0.55) OPRL1TFPI
SCHEMBL29727648 0.84 NMT1 (0.45) NMT1NMT2TLR2OPRL1

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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