SCHEMBL2042894

SCHEMBL2042894

O=C1NC(=O)/C(=C/c2ccc(-c3ccc4c(c3)CNC4=O)s2)N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 20/20 1.00

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
SCHEMBL2042898 1.00 PRF1 (1.00) PRF1
SCHEMBL14761214 1.00 PRF1 (1.00) PRF1
SCHEMBL2054373 0.89 PRF1 (1.00) PRF1
SCHEMBL14761573 0.89 PRF1 (1.00) PRF1
SCHEMBL2054374 0.89 PRF1 (1.00) PRF1
SCHEMBL14761614 0.82 PRF1 (1.00) PRF1
SCHEMBL14761616 0.82 PRF1 (1.00) PRF1
SCHEMBL2019635 0.81 PRF1 (0.68) PRF1
SCHEMBL12633692 0.80 PRF1 (1.00) PRF1
SCHEMBL14761477 0.80 PRF1 (1.00) PRF1

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-2515903-A1 COMPOUNDS, PREPARATIONS AND USES THEREOF Peter MacCallum Cancer Institute (AU) 2012-10-31 EP disclosed
WO-2011075784-A1 COMPOUNDS, PREPARATIONS AND USES THEREOF PETER MACCALLUM CANCER INSTITUTE (AU) 2011-06-30 WO disclosed