SCHEMBL1152677

SCHEMBL1152677

CN1CCC(c2ccccc2)(C(C)(C)O)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.49
DRD4 P21917 1/20 0.49
KCNH2 Q12809 2/20 0.44
OPRD1 P41143 2/20 0.44
SLC22A1 O15245 1/20 0.44
SLC6A4 P31645 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRK1 P41145 1/20 0.44
CHRM1 P11229 2/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
CHRM2 P08172 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
SETD7 Q8WTS6 1/20 0.41
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL10641018 0.90 POLB (0.42) OPRM1DRD4MAPTTSHR
SCHEMBL11073037 0.86 MMP2 (0.46) OPRM1DRD4KCNH2OPRD1SLC22A1
SCHEMBL10634773 0.86 SLC6A4 (0.44) OPRM1DRD4KCNH2OPRD1SLC22A1
SCHEMBL24119450 0.85 OPRM1 (0.52) OPRM1DRD4KCNH2OPRD1SLC22A1
SCHEMBL10640876 0.84 OPRM1 (0.49) OPRM1OPRD1OPRK1KMT2A
SCHEMBL10637222 0.83 OPRM1 (0.50) OPRM1KCNH2SLC6A4ALDH1A1MAPT
SCHEMBL10637592 0.83 OPRM1 (0.46) OPRM1KCNH2SLC6A4ALDH1A1MAPT
SCHEMBL11075430 0.82 OPRD1 (0.44) OPRM1DRD4KCNH2OPRD1SLC22A1
SCHEMBL11070339 0.81 MAPK1 (0.46) OPRM1KCNH2OPRD1SLC6A4OPRK1
SCHEMBL5755002 0.81 OPRD1 (0.43) KCNH2OPRD1SLC6A4KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8475804-B2 Compositions and methods for treatment of filovirus-mediated diseases U.S. ARMY MEDICAL RESEARCH AND MATERIAL COMMAND (US) 2013-07-02 US disclosed
US-20110028564-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES ZALICUS INC. 2011-02-03 US disclosed
EP-0094018-B1 4-ARYL-4-PIPERIDINECARBINOLS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-03-09 EP disclosed
US-4485109-A 4-Aryl-4-piperidinecarbinols E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-11-27 US disclosed
EP-0094018-A2 4-Aryl-4-piperidinecarbinols E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-11-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110028564-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES FLNA, FLNB, PIGS OPRM1 3829/4885DRD4 4834/4885KCNH2 2148/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.