SCHEMBL28050862

SCHEMBL28050862

Cc1cc(C)c(CO)c(CO)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.38
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
AMY1A P0DUB6 1/20 0.32
HSPA5 P11021 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
CYP2C9 P11712 2/20 0.32

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
SCHEMBL12622553 0.87 ALDH1A1 (0.45) SHBGKDM4EALDH1A1HSD17B10HPGD
SCHEMBL1225042 0.86 KMT2A (0.37) KDM4EALDH1A1HPGDHRH3L3MBTL1
SCHEMBL95192 0.85 HRH3 (0.40) KDM4EALDH1A1HRH3LMNAGAA
SCHEMBL21031355 0.85 TAAR1 (0.35) SHBGKDM4EALDH1A1HRH3L3MBTL1
SCHEMBL26566902 0.85 LMNA (0.42) SHBGKDM4EALDH1A1HRH3L3MBTL1
SCHEMBL7708093 0.85 HRH3 (0.36) SHBGKDM4EALDH1A1HSD17B10HRH3
SCHEMBL14449432 0.80 SHBG (0.32) SHBGHPGDHRH3GAA
SCHEMBL30425753 0.78 SHBG (0.39) SHBGKDM4EALDH1A1HSD17B10HPGD
SCHEMBL17029861 0.78 PDE4A (0.37) SHBGKDM4EALDH1A1HSD17B10HPGD
SCHEMBL357123 0.78 SHBG (0.39) SHBGKDM4EALDH1A1HSD17B10HPGD

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-105418868-A Boron modified phenolic resin, preparation method and friction material SHANDONG SHENGQUAN NEW MAT CO LTD 2016-03-23 CN disclosed