SCHEMBL7767319

SCHEMBL7767319

Nc1ccc(NC(=O)N(CC2CCC(CN(C(=O)Nc3ccc(N)cc3)C3CCCCC3)CC2)C2CCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.49
▸ EPHX1 P07099 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ SLC6A9 P48067 1/20 0.46
▸ SLC6A5 Q9Y345 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ ATM Q13315 1/20 0.45
▸ UBE2M P61081 1/20 0.44
▸ DCUN1D1 Q96GG9 1/20 0.44
▸ HSD11B1 P28845 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TP53 P04637 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ S1PR1 P21453 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ S1PR3 Q99500 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL7767315 1.00 RAB9A (0.49) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL7767324 0.86 RAB9A (0.49) RAB9ASLC6A9SLC6A5ALDH1A1ATM
SCHEMBL7767325 0.86 RAB9A (0.49) RAB9ASLC6A9SLC6A5ALDH1A1ATM
SCHEMBL285807 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL7765468 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL285806 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL7765483 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL7762757 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL7767368 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5
SCHEMBL7767298 0.84 EPHX1 (0.53) RAB9AEPHX1GAASLC6A9SLC6A5

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
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