SCHEMBL3962010

SCHEMBL3962010

CN1CCN(c2ccc(C(N)=O)c(N3CCC(F)CC3)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
MAPT P10636 2/20 0.54
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
RECQL P46063 1/20 0.54
PTK2B Q14289 1/20 0.54
JAK2 O60674 2/20 0.45
JAK1 P23458 2/20 0.45
TYK2 P29597 2/20 0.45
JAK3 P52333 2/20 0.45
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 1/20 0.45
LGMN Q99538 2/20 0.44
PARP1 P09874 1/20 0.43
CSF1R P07333 4/20 0.41
SYK P43405 2/20 0.41
RAD52 P43351 1/20 0.41
RPS6KB1 P23443 1/20 0.41
NPC1 O15118 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
Trifluoroacetic Acid SCHEMBL3539479 0.93 KDM4E (0.47) KDM4EMAPTGAAMAPK1HTT
SCHEMBL3538621 0.90 CSF1R (0.51) KDM4EMAPTGAAMAPK1HTT
SCHEMBL3541971 0.87 CSF1R (0.55) KDM4EMAPTGAAMAPK1HTT
SCHEMBL3534452 0.85 ALDH1A1 (0.56) KDM4EMAPTGAAMAPK1HTT
Hydrochloric Acid SCHEMBL3539657 0.84 ALDH1A1 (0.55) KDM4EMAPTGAAMAPK1HTT
SCHEMBL3545551 0.81 MAPT (0.82) KDM4EMAPTGAAMAPK1HTT
Trifluoroacetic Acid SCHEMBL3545922 0.81 ALDH1A1 (0.49) KDM4EMAPTGAAMAPK1HTT
Trifluoroacetic Acid SCHEMBL3539482 0.79 MAPT (0.64) KDM4EMAPTGAAMAPK1HTT
SCHEMBL27997684 0.79 PARP1 (0.51) KDM4EMAPTGAAMAPK1HTT
SCHEMBL3540352 0.79 ALDH1A1 (0.53) MAPTGAAJAK2JAK1TYK2

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-1807407-B1 AROMATIC AMIDES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA NV (BE) 2009-07-29 EP claimed