SCHEMBL8766183

SCHEMBL8766183

CC1CCC(c2ccc(Cc3ccc(N)cc3)c(F)c2)(c2ccc(Cc3ccc(N)cc3)c(F)c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TOP2A P11388 1/20 0.32
TOP2B Q02880 1/20 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
SCHEMBL8766803 0.89 ALDH1A1 (0.33) ALDH1A1L3MBTL1CYP3A4TSHRTDP1
SCHEMBL8766463 0.86 ALDH1A1 (0.35) ALDH1A1L3MBTL1CYP3A4TSHRTDP1
SCHEMBL8765909 0.85 ALDH1A1 (0.31) ALDH1A1L3MBTL1TOP2ATOP2B
SCHEMBL8765946 0.85 ALDH1A1 (0.34) ALDH1A1L3MBTL1CYP3A4TSHRTDP1
SCHEMBL8766411 0.84 ALDH1A1 (0.53) ALDH1A1L3MBTL1CYP3A4TSHRTDP1
SCHEMBL8766407 0.82 ALDH1A1 (0.33) ALDH1A1L3MBTL1CYP3A4TSHRTDP1
SCHEMBL1305036 0.82 ALDH1A1 (0.47) ALDH1A1L3MBTL1CYP3A4TSHRTDP1
SCHEMBL8945336 0.79 ESR2 (0.37) ALDH1A1CYP3A4TSHRTDP1TOP2A
SCHEMBL8766408 0.76 ALDH1A1 (0.33) ALDH1A1CYP3A4TSHR
SCHEMBL2997525 0.75 ALDH1A1 (0.57) ALDH1A1L3MBTL1

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
EP-0601813-B1 Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORP (JP) 1997-08-13 EP disclosed
US-5382688-A Diamino compounds and their production method CHISSO CORPORATION (JP) 1995-01-17 US disclosed
EP-0601813-A1 Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1994-06-15 EP disclosed