SCHEMBL7765477

SCHEMBL7765477

CN(C)c1ccc(NC(=O)N(C[C@H]2CC[C@H](CN(C(=O)Nc3ccc(N(C)C)cc3)C3CCCCCCC3)CC2)C2CCCCCCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.53
ATM Q13315 1/20 0.49
RAB9A P51151 4/20 0.48
KMT2A Q03164 1/20 0.46
UBE2M P61081 1/20 0.45
DCUN1D1 Q96GG9 1/20 0.45
SLC6A9 P48067 1/20 0.45
SLC6A5 Q9Y345 1/20 0.45
HSD11B1 P28845 1/20 0.45
NPC1 O15118 2/20 0.44
LMNA P02545 1/20 0.44
RAD52 P43351 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TP53 P04637 2/20 0.43
SHMT2 P34897 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
KDM4E B2RXH2 1/20 0.42
HDAC3 O15379 1/20 0.42

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
SCHEMBL7762749 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL285806 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7762757 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7765483 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL285807 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7767368 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7767298 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7765468 1.00 EPHX1 (0.53) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7762723 0.99 EPHX1 (0.51) EPHX1ATMRAB9AKMT2AUBE2M
SCHEMBL7762720 0.99 EPHX1 (0.51) EPHX1ATMRAB9AKMT2AUBE2M

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718281-B1 CYCLOHEXANEDIUREA DERIVATIVE AND PROCESS FOR PRODUCING THE SAME NISSIN FOOD PRODUCTS LTD (JP) 2001-06-27 EP disclosed
EP-0718281-A1 CYCLOHEXANEDIUREA DERIVATIVE AND PROCESS FOR PRODUCING THE SAME NISSIN FOOD PRODUCTS CO., LTD. (JP) 1996-06-26 EP disclosed