SCHEMBL26566902

SCHEMBL26566902

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
TAAR1 Q96RJ0 1/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
SHBG P04278 1/20 0.34
HRH3 Q9Y5N1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HTR1D P28221 2/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
C1S P09871 1/20 0.31
PRSS3 P35030 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
XIAP P98170 1/20 0.30

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
SCHEMBL28050862 0.85 SHBG (0.38) LMNAKDM4EALDH1A1GAAMAPT
SCHEMBL21031355 0.83 TAAR1 (0.35) LMNATAAR1KDM4EALDH1A1GAA
SCHEMBL23131742 0.80 LMNA (0.40) LMNAMAPTSHBG
SCHEMBL26568615 0.80 LMNA (0.40) LMNAALDH1A1MAPT
SCHEMBL111999 0.79 HRH3 (0.40) LMNATAAR1KDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL7894748 0.77 LMNA (0.42) LMNATAAR1KDM4EALDH1A1GAA
SCHEMBL12622553 0.77 ALDH1A1 (0.45) LMNAKDM4EALDH1A1SHBGPRSS1
SCHEMBL5739230 0.76 KDM4E (0.37) LMNATAAR1KDM4EALDH1A1GAA
SCHEMBL5530071 0.76 NOS2 (0.38) LMNATAAR1KDM4EALDH1A1HRH3
SCHEMBL14449432 0.75 SHBG (0.32) GAASHBGHRH3

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
EP-3609868-B1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS RAQUALIA PHARMA INC (JP) 2023-10-18 EP disclosed