SCHEMBL3989342

SCHEMBL3989342

COC(=O)C1CN=C(CCl)N1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40

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
SCHEMBL5067966 0.85 KMT2A (0.37) KMT2A
SCHEMBL3986486 0.84 ALDH1A1 (0.33) KMT2A
SCHEMBL5213808 0.76 TAAR1 (0.43) KMT2A
SCHEMBL12660848 0.71 KMT2A (0.37) KMT2A
SCHEMBL19454171 0.69 KMT2A (0.36) KMT2A
SCHEMBL17611080 0.66 KMT2A (0.33) KMT2A
Methylene Chloride SCHEMBL28127319 0.64 LMNA (0.47) KMT2A
Methylene Chloride SCHEMBL28127317 0.64 LMNA (0.47) KMT2A
SCHEMBL22362536 0.63 CHRNB2 (0.40) KMT2A
SCHEMBL8745451 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009067233-A1 BETA CARBOLINES AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-05-28 WO disclosed