SCHEMBL19976784

SCHEMBL19976784

COC[C@H](C)N/C(=N/C(=O)c1ccc(F)c(F)c1)Nc1[nH]nc2cc(F)ccc12

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 12/20 0.38
NAMPT P43490 2/20 0.37
MAP2K4 P45985 1/20 0.35
POLB P06746 1/20 0.35
DGAT2 Q96PD7 2/20 0.34

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
SCHEMBL19976803 0.91 MAPK1 (0.38) MAPK1NAMPTMAP2K4POLBDGAT2
SCHEMBL19976777 0.90 POLB (0.39) MAPK1NAMPTPOLBDGAT2
SCHEMBL19976770 0.90 MAPK1 (0.38) MAPK1NAMPTMAP2K4POLBDGAT2
SCHEMBL19976944 0.90 MAPK1 (0.36) MAPK1NAMPTMAP2K4POLB
SCHEMBL19976786 0.89 HPGD (0.48) MAPK1NAMPTDGAT2
SCHEMBL19976807 0.88 MAPK1 (0.37) MAPK1NAMPTPOLBDGAT2
SCHEMBL19976851 0.85 POLB (0.35) MAPK1NAMPTMAP2K4POLB
SCHEMBL19976739 0.84 HPGD (0.37) MAPK1POLB
SCHEMBL19976833 0.84 HPGD (0.41) MAPK1MAP2K4POLBDGAT2
SCHEMBL19976909 0.84 POLB (0.34) MAPK1NAMPTPOLB

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-9920012-B2 Indazole guanidine F1F0-ATPase inhibitors and therapeutic uses thereof LYCERA CORPORATION (US) 2018-03-20 US disclosed