SCHEMBL8237378

SCHEMBL8237378

CC1(N)CCCCCC1N

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL20220676 1.00 THRB (0.30) THRBMEN1KMT2A
SCHEMBL727318 0.97
SCHEMBL277534 0.97
Ethane SCHEMBL28302807 0.95 THRB (0.30) THRBMEN1KMT2A
SCHEMBL2461915 0.90
Glycerin SCHEMBL27486080 0.79 ALDH1A1 (0.31)
SCHEMBL19067421 0.78 THRB (0.41) THRBMEN1KMT2A
SCHEMBL24760387 0.77 GAA (0.33) THRBMEN1KMT2A
SCHEMBL28872817 0.76 KDM1A (0.37)
SCHEMBL20526081 0.75 F2 (0.44)

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-2007071738-A1 CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS NOVARTIS AG (CH) 2007-06-28 WO disclosed