SCHEMBL19976759

SCHEMBL19976759

COC[C@H](C)N/C(=N/C(=O)c1ccc(F)c(F)c1)Nc1[nH]nc2cncc(Cl)c12

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.35
POLB P06746 1/20 0.33
MAPK1 P28482 12/20 0.32
DGAT2 Q96PD7 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31
ALOX12 P18054 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL19976909 0.93 POLB (0.34) LMNAHPGDPOLBMAPK1ALDH1A1
SCHEMBL19976777 0.82 POLB (0.39) LMNAHPGDPOLBMAPK1DGAT2
SCHEMBL19976784 0.82 MAPK1 (0.38) POLBMAPK1DGAT2
SCHEMBL19976740 0.81 HPGD (0.39) LMNAHPGDPOLBMAPK1DGAT2
SCHEMBL19976880 0.80 PDE10A (0.36) LMNAHPGDPOLBMAPK1
SCHEMBL19362794 0.80 RAB9A (0.47) LMNAKDM4EALDH1A1GAA
SCHEMBL19976851 0.79 POLB (0.35) LMNAHPGDPOLBMAPK1KDM4E
SCHEMBL19976944 0.79 MAPK1 (0.36) LMNAHPGDPOLBMAPK1KDM4E
SCHEMBL19976739 0.78 HPGD (0.37) LMNAHPGDPOLBMAPK1ALDH1A1
SCHEMBL18558416 0.78 RAB9A (0.37) LMNAHPGDMAPK1

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