SCHEMBL18860894

SCHEMBL18860894

COC1C(C)CC(=O)N1C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.32
CYP2D6 P10635 1/20 0.31
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL16317735 0.72
SCHEMBL10119632 0.72
SCHEMBL8297562 0.71 BRD4 (0.33) BRD4CYP2D6KMT2A
SCHEMBL17148563 0.69 BRD4 (0.31) BRD4
SCHEMBL7280355 0.68
SCHEMBL27660180 0.68 BRD4 (0.42) BRD4
SCHEMBL8298089 0.67 KMT2A (0.32) BRD4KMT2A
SCHEMBL12567851 0.66
SCHEMBL13185492 0.66
SCHEMBL2618677 0.66 ADRA2C (0.50) KMT2A

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
EP-1599532-B1 POLYMER COMPOSITIONS CONTAINING AN ULTRAVIOLET LIGHT ABSORBING COMPOUND EASTMAN CHEM CO (US) 2017-05-17 EP disclosed