SCHEMBL17714031

SCHEMBL17714031

NCCCC[C@H](NC(=O)OC1=CC2CCC1C2)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.43
FOLH1 Q04609 1/20 0.41
CPB2 Q96IY4 14/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL5261062 0.72 SLC1A3 (0.51) FOLH1CPB2CA1CA2
SCHEMBL5261067 0.72 SLC1A3 (0.51) FOLH1CPB2CA1CA2
SCHEMBL28456990 0.70 FOLH1 (0.60) FOLH1CPB2CA1CA2
SCHEMBL17714030 0.70 FOLH1 (0.41) FOLH1CPB2
SCHEMBL28263995 0.70 HDAC4 (0.52) FOLH1CPB2
SCHEMBL454654 0.70 HDAC4 (0.52) FOLH1CPB2
SCHEMBL25409269 0.69 TGM2 (0.47) FOLH1CA1CA2
SCHEMBL9698704 0.69 FOLH1 (0.58) FOLH1CPB2CA1CA2
SCHEMBL3435138 0.69 FOLH1 (0.58) FOLH1CPB2CA1CA2
SCHEMBL19689232 0.69 FOLH1 (0.43) FOLH1CPB2CA1CA2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107002088-B Incorporation of unnatural amino acids into proteins 英国研究与创新署 2022-01-11 CN disclosed
US-10738339-B2 Use of eRF1 mutants in unnatural amino acid incorporation UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2020-08-11 US disclosed
EP-3212799-B1 INCORPORATION OF UNNATURAL AMINO ACIDS INTO PROTEINS RES & INNOVATION UK (GB) 2019-04-17 EP disclosed
US-20170356023-A1 USE OF eRF1 MUTANTS IN UNNATURAL AMINO ACID INCORPORATION UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2017-12-14 US disclosed
EP-3212799-A1 INCORPORATION OF UNNATURAL AMINO ACIDS INTO PROTEINS Medical Research Council (GB) 2017-09-06 EP disclosed
WO-2016066995-A1 INCORPORATION OF UNNATURAL AMINO ACIDS INTO PROTEINS MEDICAL RESEARCH COUNCIL (GB) 2016-05-06 WO disclosed