SCHEMBL11601331

SCHEMBL11601331

CC(C)(C)NC(=O)[CH]C(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.37
POLB P06746 1/20 0.35
LMNA P02545 1/20 0.33
EPHX1 P07099 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL11601703 0.78 EGFR (0.38) EGFRPOLBLMNAEPHX1MEN1
SCHEMBL1700981 0.71 EGFR (0.54) EGFRPOLBLMNAEPHX1MEN1
SCHEMBL6139449 0.71
SCHEMBL2534565 0.71 EGFR (0.54) EGFRPOLBLMNAEPHX1MEN1
SCHEMBL8183701 0.69
SCHEMBL11602648 0.68 EGFR (0.38) EGFRPOLBLMNAEPHX1MEN1
SCHEMBL19669756 0.68 EGFR (0.47) EGFRPOLBLMNAEPHX1MEN1
SCHEMBL1515475 0.67 EGFR (0.41) EGFRPOLBLMNAEPHX1MEN1
SCHEMBL26705 0.67
SCHEMBL11600492 0.67 EGFR (0.37) EGFRPOLBLMNAEPHX1MEN1

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-4111933-A PROTECTION OF FUNCTIONAL GROUPS DURING REACTION AND THEIR SUBSEQUENT RESTORATION BAYER AKTIENGESELLSCHAFT (DE) 1978-09-05 US disclosed