SCHEMBL20122206

SCHEMBL20122206

CC(Cl)C(=O)NC1CCO1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.43
HPGD P15428 2/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL27432602 0.83 KMT2A (0.46) ATMHPGDTSHRNPSR1KMT2A
SCHEMBL27377772 0.74
SCHEMBL11067027 0.69 ATM (0.73) ATMHPGDTSHRNPSR1HTT
SCHEMBL1259220 0.67
SCHEMBL11634507 0.67 HPGD (0.35) ATMHPGDLMNAHTTKMT2A
SCHEMBL20548158 0.65 TAS1R3 (0.54) ATM
SCHEMBL12858462 0.63 JAK2 (0.53) ATMHPGDKMT2AMEN1ALDH1A1
SCHEMBL6344160 0.63 EPHX2 (0.58) LMNAHTTKMT2A
SCHEMBL13470294 0.63 HPGD (0.38) ATMHPGDLMNAHTTKMT2A
SCHEMBL6497835 0.62 ALDH1A1 (0.35) ALDH1A1

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
US-9962521-B2 Shape memory materials by surface modification UNIVERSITY OF BRITISH COLUMBIA (CA) 2018-05-08 US disclosed