SCHEMBL19554253

SCHEMBL19554253

N#Cc1cc(C(=O)O)c(NC(=O)c2ccc3cc(Cl)ccc3c2)cc1OC(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F11 P03951 1/20 0.46
KLKB1 P03952 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 4/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PKM P14618 1/20 0.44
SERPINE1 P05121 4/20 0.43
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
KCNK2 O95069 2/20 0.41
KCNK10 P57789 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL19554188 0.90 F11 (0.47) F11KLKB1NPSR1MEN1KMT2A
SCHEMBL19554266 0.87 KMT2A (0.55) NPSR1MEN1KMT2APKMSERPINE1
SCHEMBL19570245 0.84 NPC1 (0.49) F11KLKB1SMN1; SMN2GAANPSR1
SCHEMBL19554171 0.84 PDE5A (0.48) NPSR1MEN1KMT2APKMSERPINE1
SCHEMBL19554152 0.84 MEN1 (0.47) SMN1; SMN2GAANPSR1MEN1KMT2A
SCHEMBL19554136 0.83 MEN1 (0.48) NPSR1MEN1KMT2APKMSERPINE1
SCHEMBL19554246 0.82 PDE4B (0.44) F11KLKB1SMN1; SMN2NPSR1MEN1
SCHEMBL19554190 0.81 KMT2A (0.49) NPSR1MEN1KMT2APKMSERPINE1
SCHEMBL19554201 0.81 SERPINE1 (0.59) SMN1; SMN2GAANPSR1MEN1KMT2A
SCHEMBL19554218 0.79 MEN1 (0.47) NPSR1MEN1KMT2APKMSERPINE1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO claimed
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed