SCHEMBL10776487

SCHEMBL10776487

CCNC(=O)N=C(OC)c1cc(Oc2ccc(C(F)(F)F)cn2)ccc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ SCN9A Q15858 13/20 0.44
▸ SCN10A Q9Y5Y9 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPK1 P28482 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ TTR P02766 1/20 0.42
▸ PPOX P50336 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TDP1 Q9NUW8 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
SCHEMBL10773705 0.91 RAB9A (0.52) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL10775604 0.88 RAB9A (0.47) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL10772934 0.88 RAB9A (0.52) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL10778096 0.86 RAB9A (0.50) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL10772114 0.86 LMNA (0.50) RAB9AMAPTLMNAPOLBMEN1
SCHEMBL10775897 0.80 RAB9A (0.49) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL11009701 0.79 RAB9A (0.68) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL10781266 0.78 RAB9A (0.48) RAB9AMAPTNPSR1SCN9ASCN10A
SCHEMBL11008594 0.77 RAB9A (0.54) RAB9AMAPTNPSR1LMNASCN9A
SCHEMBL10775596 0.77 LMNA (0.51) RAB9AMAPTNPSR1LMNAPOLB

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
US-4690708-A Herbicides derived from aryloxybenzenecarboxylic acid imides RHONE-POULENC AGROCHIMIE (FR) 1987-09-01 — — US disclosed
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