SCHEMBL11702116

SCHEMBL11702116

Cc1ccc(C(F)(F)F)cc1N(CC=O)C(=O)CCl

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 5/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ TP53 P04637 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.35
▸ TAS2R14 Q9NYV8 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ GRM5 P41594 1/20 0.34
▸ CRHR1 P34998 1/20 0.33
▸ POLQ O75417 1/20 0.33

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
SCHEMBL11704132 0.80 ALDH1A1 (0.39) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11697095 0.79 ALDH1A1 (0.41) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11701062 0.78 PAX8 (0.44) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11697994 0.77 ALDH1A1 (0.44) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11872117 0.76 ALDH1A1 (0.59) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11700155 0.76 ALDH1A1 (0.36) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11703111 0.73 ALDH1A1 (0.50) ALDH1A1TP53NPC1RAB9AMEN1
SCHEMBL11866789 0.72 ALDH1A1 (0.39) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11260320 0.69 ALDH1A1 (0.52) ALDH1A1TP53NPC1LMNARAB9A
SCHEMBL11873283 0.68 TP53 (0.49) ALDH1A1TP53NPC1LMNARAB9A

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
US-4046554-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1977-09-06 — — US disclosed
US-3966811-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-06-29 — — US disclosed
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