SCHEMBL10772745

SCHEMBL10772745

CSC(=NC(=O)N(C)C)c1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 1/20 0.48
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TTR P02766 1/20 0.47
▸ PPOX P50336 1/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.46
▸ ATM Q13315 1/20 0.45
▸ LMNA P02545 5/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ HTT P42858 2/20 0.44
▸ FAAH O00519 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ FFAR1 O14842 1/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MAPT P10636 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ XBP1 P17861 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
SCHEMBL10772766 0.90 SMN1; SMN2 (0.52) LIPEKMT2AMEN1TDP1TTR
SCHEMBL10772102 0.88 KMT2A (0.49) LIPEKMT2AMEN1TDP1TTR
SCHEMBL10775901 0.87 LMNA (0.49) LIPEKMT2AMEN1TDP1TTR
SCHEMBL10777765 0.86 LMNA (0.47) LIPEKMT2AMEN1TDP1TTR
SCHEMBL10775599 0.85 RAB9A (0.49) LIPEKMT2AMEN1TDP1TTR
SCHEMBL10452504 0.81 KMT2A (0.69) LIPEKMT2AMEN1TDP1TTR
SCHEMBL11455024 0.80 KMT2A (0.61) LIPEKMT2AMEN1TDP1TTR
SCHEMBL10775218 0.80 SMN1; SMN2 (0.58) LIPEKMT2AMEN1TDP1TTR
Potassium Ion SCHEMBL11458215 0.80 KMT2A (0.56) LIPEKMT2AMEN1TDP1TTR
SCHEMBL11455998 0.80 KMT2A (0.56) LIPEKMT2AMEN1TDP1TTR

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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