SCHEMBL8766254

SCHEMBL8766254

CCCCC1=CCC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
CYP2C9 P11712 1/20 0.40
KMT2A Q03164 1/20 0.40
OPRM1 P35372 10/20 0.38
OPRL1 P41146 7/20 0.38
DRD4 P21917 1/20 0.33
OPRD1 P41143 3/20 0.33
OPRK1 P41145 3/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
GRIN1 Q05586 1/20 0.33
KCNH2 Q12809 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
CYP2D6 P10635 1/20 0.33
HTR2A P28223 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
SCHEMBL21189656 0.67
SCHEMBL338375 0.65
SCHEMBL8639794 0.65 DRD2 (0.38) OPRM1OPRL1OPRD1OPRK1HTR2A
SCHEMBL8636331 0.65 OPRL1 (0.42) OPRM1OPRL1OPRD1OPRK1CHRM2
SCHEMBL8639820 0.65 OPRM1 (0.35) OPRM1OPRL1OPRD1OPRK1CHRM1
SCHEMBL9682167 0.64 MEN1 (0.48) MEN1CYP2C9KMT2AOPRM1OPRL1
SCHEMBL11740559 0.62 ADRA1A (0.57) KMT2AOPRM1DRD4GRIN2DGRIN3B
SCHEMBL8094488 0.62 CYP1A2 (0.42) MEN1CYP2C9KMT2AOPRM1OPRL1
SCHEMBL8765862 0.62 MEN1 (0.47) MEN1CYP2C9KMT2AOPRM1OPRL1
SCHEMBL6546828 0.61 OPRM1 (0.34) OPRM1OPRL1OPRD1OPRK1MMP2

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