SCHEMBL8766447

SCHEMBL8766447

CC1CCC(c2cccc(F)c2)(c2cccc(F)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.47
CCR2 P41597 1/20 0.43
SLC6A4 P31645 3/20 0.43
SLC6A3 Q01959 3/20 0.43
SLC6A2 P23975 2/20 0.43
CHRNA1 P02708 1/20 0.42
CHRNB1 P11230 1/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
CHRNA4 P43681 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
HSD11B1 P28845 1/20 0.38
HSD11B2 P80365 1/20 0.38
RCOR1 Q9UKL0 1/20 0.36
ACHE P22303 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36

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
SCHEMBL8766534 0.83 HTR2A (0.45) KDM1ACCR2SLC6A4SLC6A3SLC6A2
SCHEMBL4344633 0.81 OPRL1 (0.49) KDM1ACCR2SLC6A4SLC6A3SLC6A2
SCHEMBL8766953 0.80 CCR2 (0.42) CCR2SLC6A3SLC6A2CHRNA1CHRNB1
SCHEMBL8766910 0.79 HTR2A (0.42) KDM1ASLC6A4SLC6A3SLC6A2CHRNA1
SCHEMBL17931718 0.79 OPRM1 (0.41) CCR2OPRM1
SCHEMBL8767025 0.77 SLC6A4 (0.56) KDM1ASLC6A4SLC6A3SLC6A2HTR2A
SCHEMBL8766501 0.77 HTR2A (0.40) KDM1ASLC6A4SLC6A3SLC6A2HTR2A
SCHEMBL8101425 0.77 OPRM1 (0.50) OPRM1
SCHEMBL8766539 0.76 HTT (0.37) ACHEOPRM1OPRD1OPRK1
SCHEMBL8767227 0.76 SLC6A4 (0.42) KDM1ASLC6A4SLC6A3SLC6A2HTR2A

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 4 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-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US 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