SCHEMBL9844400

SCHEMBL9844400

Cc1cccn2c(-c3ccc(Oc4ccccc4)cc3)nnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HSD17B10 Q99714 2/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
ATM Q13315 1/20 0.41
MGLL Q99685 1/20 0.41
TNK2 Q07912 7/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
BTK Q06187 1/20 0.40
HSD11B1 P28845 1/20 0.39
TP53 P04637 1/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL9844367 0.86 KDM4E (0.50) KDM4ENPC1RAB9AALDH1A1NPSR1
SCHEMBL9844107 0.86 ALDH1A1 (0.53) KDM4ENPC1RAB9AALDH1A1NPSR1
SCHEMBL9844382 0.84 KDM4E (0.43) KDM4EHSD17B10GLAMGLLTNK2
SCHEMBL9844335 0.81 GAA (0.49) KDM4ENPC1RAB9AALDH1A1NPSR1
SCHEMBL9844105 0.78 KDM4E (0.57) KDM4ENPC1RAB9AALDH1A1NPSR1
SCHEMBL9690979 0.75 MAPT (0.43) KDM4ENPC1RAB9AALDH1A1NPSR1
SCHEMBL9844257 0.68 HSD11B1 (0.47) KDM4ENPC1RAB9AALDH1A1HSD17B10
SCHEMBL10179020 0.68 NR1I2 (0.46) KDM4ENPC1RAB9AALDH1A1NPSR1
SCHEMBL9844092 0.68 HSD11B1 (0.54) KDM4ENPC1RAB9AALDH1A1GLA
Diphenylether SCHEMBL9363545 0.67 LTA4H (0.71) LMNASMN1; SMN2

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-0441718-A1 Herbicidally active triazolopyridine compounds RHONE-POULENC AGROCHIMIE (FR) 1991-08-14 EP disclosed