SCHEMBL9603360

SCHEMBL9603360

O=C(O)[C@H]1C[C@@H](OCc2ccccc2)CN1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 11/20 0.59
BDKRB2 P30411 2/20 0.49
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
MMP9 P14780 1/20 0.45
S1PR5 Q9H228 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
SCHEMBL27224005 1.00 AGTR2 (0.59) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL9033443 1.00 AGTR2 (0.59) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL3784713 1.00 AGTR2 (0.59) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL9033440 1.00 AGTR2 (0.59) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL5635251 0.89 AGTR2 (0.57) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL5635255 0.89 AGTR2 (0.57) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL5754489 0.89 AGTR2 (0.57) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL18154378 0.89 BDKRB2 (0.50) AGTR2BDKRB2CTSLCTSBCTSK
SCHEMBL23461721 0.88 AGTR2 (0.52) AGTR2BDKRB2S1PR5
SCHEMBL6515997 0.88 AGTR2 (0.56) AGTR2BDKRB2

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-4169922-A1 FGFR AND MUTATION INHIBITOR THEREOF, AND PREPARATION METHOD THEREFOR AND USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2023-04-26 EP disclosed
WO-1993001174-A1 THIAZOLIDINE DERIVATIVES AND THEIR USE AS ANTI-VIRAL COMPOUNDS GLAXO GROUP LIMITED (GB) 1993-01-21 WO disclosed