SCHEMBL30482986

SCHEMBL30482986

CC(=C(F)C(=O)O)N(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
FFAR3 O14843 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32

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
SCHEMBL988835 0.74 CA1 (0.36) FFAR3LCKFYN
SCHEMBL988834 0.74 CA1 (0.36) FFAR3LCKFYN
SCHEMBL14690127 0.74 CA1 (0.36) FFAR3LCKFYN
SCHEMBL9156418 0.71 LDHA (0.33) ALDH1A1TSHR
SCHEMBL9156417 0.71 LDHA (0.33) ALDH1A1TSHR
SCHEMBL500714 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL936585 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL11125449 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL10604698 0.69
SCHEMBL26929225 0.69

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-4370506-A1 PYRAZINE COMPOUNDS AS INHIBITORS OF FLT3 Biomea Fusion, Inc. (US) 2024-05-22 EP disclosed
WO-2023129667-A1 PYRAZINE COMPOUNDS AS INHIBITORS OF FLT3 BIOMEA FUSION, INC. (US) 2023-07-06 WO disclosed