SCHEMBL22016770

SCHEMBL22016770

C=CCC1(CC=C)CCCN1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TDP1 Q9NUW8 1/20 0.40
NR2F2 P24468 2/20 0.39
GALR3 O60755 1/20 0.39
TNF P01375 1/20 0.39
NOD1 Q9Y239 1/20 0.39
GAA P10253 1/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
RECQL P46063 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL9733790 0.79 CD274 (0.33) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL10339373 0.77 NPC1 (0.34) NPC1RAB9ATDP1NR2F2GALR3
SCHEMBL16053423 0.76
SCHEMBL9735306 0.74 MEN1 (0.32) MEN1KMT2AALDH1A1POLB
SCHEMBL9735303 0.74 MEN1 (0.32) MEN1KMT2AALDH1A1POLB
SCHEMBL11500645 0.74 MEN1 (0.32) MEN1KMT2AALDH1A1POLB
SCHEMBL10499597 0.74 NPC1 (0.34) NPC1RAB9ATDP1NR2F2GALR3
SCHEMBL18365906 0.73 GAA (0.32) NPC1RAB9AGAA
SCHEMBL30067948 0.72 DPP4 (0.31)
SCHEMBL18039727 0.71 NPC1 (0.33) NPC1RAB9A

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-11542407-B2 Fluorinated ether compound, fluorinated ether composition, coating liquid, article and its production method AGC Inc. (JP) 2023-01-03 US disclosed
US-20200157376-A1 FLUORINATED ETHER COMPOUND, FLUORINATED ETHER COMPOSITION, COATING LIQUID, ARTICLE AND ITS PRODUCTION METHOD AGC Inc. (JP) 2020-05-21 US disclosed