SCHEMBL18249778

SCHEMBL18249778

CSC(=N)N(C(=O)CC#N)C(=O)CC#N

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.34
KCNH2 Q12809 1/20 0.30

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
SCHEMBL11675072 0.69 MAPT (0.33) MCL1
SCHEMBL23554279 0.66
SCHEMBL333490 0.66
SCHEMBL18249791 0.65 ALDH1A1 (0.37)
SCHEMBL1405183 0.63 LMNA (0.48) MCL1
SCHEMBL4943847 0.63 LMNA (0.48) MCL1
SCHEMBL1279919 0.61
SCHEMBL18249855 0.61 ALDH1A1 (0.36)
Hydrochloric Acid SCHEMBL5796983 0.61 LMNA (0.46) MCL1
SCHEMBL9653268 0.61

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-3298005-A2 ANTI-CANCER COMPOUNDS The Regents of The University of California (US) 2018-03-28 EP disclosed
WO-2016187620-A2 ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-24 WO disclosed