SCHEMBL14449366

SCHEMBL14449366

Cc1ccc2c(c1)OCC(C)(F)C2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 2/20 0.37
▸ SIGMAR1 Q99720 2/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ MMP12 P39900 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ RAD52 P43351 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ TMEM97 Q5BJF2 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
SCHEMBL14449822 0.84 HTR1A (0.35) HTR2BSIGMAR1HTR1ASLC6A2HTR2C
SCHEMBL5985680 0.82 HTR2B (0.39) HTR2BSIGMAR1HTR1ASLC6A2HTR2C
SCHEMBL12233255 0.75 KDM4E (0.35) HTR2CMMP12ALDH1A1GAAKDM4E
SCHEMBL12301085 0.73 KDM4E (0.36) HTR2CMMP12ALDH1A1GAAMAPT
SCHEMBL14449367 0.72 KDM4E (0.33) HTR2CMMP12ALDH1A1GAAMAPT
SCHEMBL14449365 0.72 HTR2B (0.37) HTR2BSIGMAR1HTR1ASLC6A2HTR2C
SCHEMBL14449376 0.71 HTR7 (0.35) HTR2BSIGMAR1HTR7TMEM97
SCHEMBL12180466 0.71 KDM4E (0.38) ALDH1A1GAAMAPTKDM4ERAD52
SCHEMBL428277 0.71 HTR2B (0.41) HTR2BSIGMAR1HTR1ASLC6A2HTR2C
SCHEMBL11926955 0.70 HTR1A (0.38) HTR2BSIGMAR1HTR1ASLC6A2HTR2C

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-7247355-B2 Liquid crystal compound having chroman ring, liquid crystal composition comprising the compound and liquid crystal display device comprising the composition CHISSO CORPORATION (JP) 2007-07-24 — — US disclosed
US-7247355-B2 Liquid crystal compound having chroman ring, liquid crystal composition comprising the compound and liquid crystal display device comprising the composition CHISSO CORPORATION (JP) 2007-07-24 — — US disclosed
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