SCHEMBL29636478

SCHEMBL29636478

C[C@@H](NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.67
▸ OPRM1 P35372 2/20 0.67
▸ OPRD1 P41143 2/20 0.67
▸ ECE1 P42892 7/20 0.62
▸ ALOX15 P16050 1/20 0.62
▸ LTA4H P09960 1/20 0.62
▸ MME P08473 1/20 0.60

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
SCHEMBL29704583 1.00 ACE (0.67) ACEOPRM1OPRD1ECE1ALOX15
SCHEMBL30052393 0.96 OPRM1 (0.66) ACEOPRM1OPRD1ECE1LTA4H
SCHEMBL10753140 0.95 ACE (0.71) ACEECE1ALOX15
SCHEMBL31259939 0.95 ACE (0.71) ACEECE1ALOX15
SCHEMBL10753134 0.95 ACE (0.71) ACEECE1ALOX15
SCHEMBL29448058 0.95 ACE (0.71) ACEECE1ALOX15
SCHEMBL2182648 0.94 LTA4H (0.69) ACEECE1ALOX15LTA4HMME
SCHEMBL2182644 0.94 LTA4H (0.69) ACEECE1ALOX15LTA4HMME
SCHEMBL31477993 0.94 LTA4H (0.69) ACEECE1ALOX15LTA4HMME
SCHEMBL31619984 0.94 LTA4H (0.69) ACEECE1ALOX15LTA4HMME

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-20240279594-A1 CYANOBACTERIAL HOSTS AND METHODS FOR PRODUCING CHEMICALS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-08-22 — — US disclosed
US-11970689-B2 Cyanobacterial hosts and methods for producing chemicals UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-04-30 — — US disclosed
US-20220372427-A1 CYANOBACTERIAL HOSTS AND METHODS FOR PRODUCING CHEMICALS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-11-24 — — US disclosed
US-11352601-B2 Cyanobacterial hosts and methods for producing chemicals UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-06-07 — — US disclosed
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