SCHEMBL30541328

SCHEMBL30541328

CCOC(=O)C[C@H](N)c1cc(-c2ccccc2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 2/20 0.44
▸ FFAR1 O14842 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ SLC1A3 P43003 1/20 0.40
▸ SLC1A2 P43004 1/20 0.40
▸ SLC1A1 P43005 1/20 0.40
▸ MMEL1 Q495T6 1/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ DHODH Q02127 1/20 0.38
▸ SCN9A Q15858 1/20 0.38
▸ PTPN1 P18031 1/20 0.38

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
SCHEMBL28373927 1.00 ACLY (0.44) ACLYFFAR1ALDH1A1TSHRSLC1A3
SCHEMBL28368304 0.90 CTSA (0.39) ACLYALDH1A1MMEL1
SCHEMBL30541447 0.87 AKR1C3 (0.43) FFAR1ALDH1A1TSHRRXRARXRB
SCHEMBL28372595 0.87 AKR1C3 (0.43) FFAR1ALDH1A1TSHRRXRARXRB
SCHEMBL30541463 0.86 FFAR1 (0.38) FFAR1ALDH1A1TSHR
SCHEMBL30671435 0.84 CTSA (0.45) FFAR1RXRARXRBDHODH
SCHEMBL20545648 0.84 FFAR1 (0.51) ACLYFFAR1TSHRSLC1A3SLC1A2
SCHEMBL20545647 0.84 FFAR1 (0.51) ACLYFFAR1TSHRSLC1A3SLC1A2
SCHEMBL28368458 0.84 CTSA (0.49) —
SCHEMBL30541339 0.84 CTSA (0.49) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3615514-B1 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS INC (US) 2023-11-22 — — EP disclosed
CN-110914242-B Propionic acid derivatives and methods of use thereof 阿维亚拉药品有限公司 2023-07-25 — — CN disclosed
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