SCHEMBL9838818

SCHEMBL9838818

CC(Cl)(C(=O)NC1CC1)c1ccc(N)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.41
GAA P10253 2/20 0.41
RAB9A P51151 1/20 0.41
EPHX2 P34913 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
SSTR4 P31391 3/20 0.37
SMYD3 Q9H7B4 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
SSTR1 P30872 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CCR1 P32246 1/20 0.35
TSHR P16473 1/20 0.35
HSD11B1 P28845 1/20 0.35

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
SCHEMBL9837856 0.94 RAB9A (0.49) EPHX1GAARAB9AEPHX2MEN1
SCHEMBL9837842 0.93 EPHX1 (0.51) EPHX1GAARAB9AEPHX2MEN1
SCHEMBL9838879 0.81 GAA (0.46) EPHX1GAARAB9AEPHX2LMNA
SCHEMBL9838897 0.78 EPHX1 (0.51) EPHX1GAARAB9AEPHX2MEN1
SCHEMBL9837559 0.77 RAB9A (0.54) EPHX1GAARAB9AEPHX2MEN1
SCHEMBL9838913 0.76 RAB9A (0.49) EPHX1GAARAB9AEPHX2MEN1
SCHEMBL9837558 0.75 RAB9A (0.51) EPHX1GAARAB9AEPHX2MEN1
SCHEMBL9838968 0.75 EPHX1 (0.48) EPHX1GAARAB9AEPHX2KMT2A
SCHEMBL31488958 0.73 LTA4H (0.42) EPHX1GAARAB9ALMNASSTR4
SCHEMBL25464169 0.71 LMNA (0.50) EPHX1RAB9AMEN1KMT2ALMNA

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
EP-0276122-B1 CYCLOALKYL-SUBSTITUTED 4-AMINOPHENYL HALO DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-08-07 EP disclosed
US-4847295-A ANTITUMOR AGENTS FARMITALIA CARLO ERBA S.R.L. (IT) 1989-07-11 US disclosed
EP-0276122-A2 Cycloalkyl-substituted 4-aminophenyl halo derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-07-27 EP disclosed