SCHEMBL22471869

SCHEMBL22471869

CCCCCCCCCCCCCCCCC(C=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.43
HTR2A P28223 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ASAH1 Q13510 2/20 0.41
TACR3 P29371 1/20 0.41
CSNK1E P49674 1/20 0.41
GPR84 Q9NQS5 3/20 0.40
ALDH1A1 P00352 2/20 0.40
ACER2 Q5QJU3 1/20 0.40
FFAR1 O14842 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
POLB P06746 1/20 0.40
CNR2 P34972 1/20 0.40
SIGMAR1 Q99720 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
SCHEMBL22471817 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL9340451 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL22471836 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL8352391 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL8351977 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL8357721 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL25273765 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL22471827 1.00 NAAA (0.43) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL4858092 0.98 NAAA (0.41) NAAAHTR2ATDP1ASAH1TACR3
SCHEMBL7129264 0.93 POLB (0.45) NAAATACR3ALDH1A1POLBCNR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023100627-A1 REVERSIBLY THERMOCHROMIC MICROCAPSULE PIGMENT 株式会社パイロットコーポレーション 2023-06-08 WO disclosed
CN-113767159-A Reversible thermochromic microcapsule pigments 百乐墨水株式会社 2021-12-07 CN disclosed
WO-2020196073-A1 REVERSIBLE THERMOCHROMIC MICROCAPSULE PIGMENT パイロットインキ株式会社 2020-10-01 WO disclosed