Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL27745909

CC(C)(C)OC=O.O=C(Nc1ccc(F)cc1)NC1CCNCC1

nearest known ligand 0.59

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Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 5/20 0.59
▸ NPC1 O15118 4/20 0.55
▸ RAB9A P51151 4/20 0.55
▸ RECQL P46063 1/20 0.51
▸ EPHX2 P34913 12/20 0.49
▸ FAAH O00519 1/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL1425082 0.86 EPHX1 (0.72) EPHX1NPC1RAB9ARECQLEPHX2
Hydrochloric Acid SCHEMBL4601195 0.85 EPHX1 (0.70) EPHX1NPC1RAB9ARECQLEPHX2
Tert-Butyl Formate SCHEMBL28822399 0.83 F10 (0.49) EPHX2FAAHKMT2A
Tert-Butyl Formate SCHEMBL27826415 0.83 HTR6 (0.46) EPHX1
Trifluoroacetic Acid SCHEMBL2953636 0.82 EPHX1 (0.65) EPHX1NPC1RAB9ARECQLEPHX2
SCHEMBL11417263 0.76 RAB9A (0.84) EPHX1NPC1RAB9ARECQLEPHX2
SCHEMBL11927282 0.76 EPHX1 (0.63) EPHX1NPC1RAB9AEPHX2MEN1
SCHEMBL14997509 0.76 EPHX1 (0.72) EPHX1NPC1RAB9AEPHX2MEN1
SCHEMBL12995588 0.76 EPHX1 (0.63) EPHX1NPC1RAB9AEPHX2MEN1
SCHEMBL14984059 0.75 NPC1 (0.74) EPHX1NPC1RAB9AEPHX2MEN1

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
CN-101326166-A Novel N-sulfamoyl-piperidine amides for the prevention or treatment of obesity and related disorders SOLVAY PHARM GMBH (DE) 2008-12-17 — — CN disclosed
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