SCHEMBL28888366

SCHEMBL28888366

CCCCCCCCCCCCCCCc1cc(C)cc(-c2cccc3[nH]nnc23)c1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.36
CTSG P08311 2/20 0.36
TYR P14679 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALOX5 P09917 5/20 0.34
PTGS2 P35354 4/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
BID P55957 3/20 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
SCHEMBL5814959 1.00 ELANE (0.36) ELANECTSGTYRKDM4EALDH1A1
SCHEMBL31570223 1.00 ELANE (0.36) ELANECTSGTYRKDM4EALDH1A1
SCHEMBL28388188 1.00 ELANE (0.36) ELANECTSGTYRKDM4EALDH1A1
SCHEMBL7808234 0.95 ELANE (0.34) ELANECTSGTYRKDM4EALDH1A1
SCHEMBL28450073 0.88 LPL (0.36) ELANECTSGALOX5PTGS2CYP3A4
SCHEMBL9068079 0.87 ALOX5 (0.44) ELANECTSGTYRKDM4EALDH1A1
SCHEMBL27396418 0.86 TLR8 (0.39) ELANECTSGTYRALOX5PTGS2
SCHEMBL27494563 0.86 TLR8 (0.39) ELANECTSGTYRALOX5PTGS2
SCHEMBL29565133 0.86 ALOX5 (0.45) ELANECTSGTYRKDM4EALDH1A1
SCHEMBL5511834 0.85 PTGS2 (0.36) ELANECTSGTYRALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112601668-B Thermosensitive recording material and color-developing agent 索理思科技开曼公司 2022-07-29 CN disclosed
CN-110234515-B Recording material and recording sheet 日本曹达株式会社 2022-02-11 CN disclosed
CN-110709255-B Recording material and compound 日本曹达株式会社 2021-08-06 CN disclosed
CN-109641472-B Recording material and recording sheet 日本曹达株式会社 2021-07-27 CN disclosed
CN-112601668-A Thermosensitive recording material and color-developing agent 索理思科技开曼公司 2021-04-02 CN disclosed
CN-110709255-A Recording material and compound 日本曹达株式会社 2020-01-17 CN disclosed