SCHEMBL11073037

SCHEMBL11073037

CN1CCC(c2ccc(Oc3ccccc3)cc2)(C(C)(C)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.46
MMP9 P14780 4/20 0.46
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MMP1 P03956 1/20 0.39
ADAM17 P78536 1/20 0.39
KCNH2 Q12809 2/20 0.38
CCR6 P51684 1/20 0.38
OPRM1 P35372 3/20 0.38
SLC22A1 O15245 1/20 0.38
SLC6A4 P31645 1/20 0.38
ADRA1A P35348 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
DRD4 P21917 1/20 0.37

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
SCHEMBL1152677 0.86 OPRM1 (0.49) MAPTKMT2AKCNH2OPRM1SLC22A1
SCHEMBL10641018 0.84 POLB (0.42) MAPTPOLBSMN1; SMN2OPRM1DRD4
SCHEMBL11074351 0.84 SLC6A4 (0.43) MMP9MAPTKMT2AMMP1CCR6
SCHEMBL10640876 0.79 OPRM1 (0.49) KMT2AOPRM1OPRD1OPRK1
SCHEMBL10637592 0.77 OPRM1 (0.46) MAPTKMT2ALMNASMN1; SMN2KCNH2
SCHEMBL10637222 0.77 OPRM1 (0.50) MAPTPOLBKMT2ALMNAKCNH2
SCHEMBL10634827 0.76 KMT2A (0.58) KMT2AGAASMN1; SMN2OPRM1SLC6A4
SCHEMBL10637675 0.75 KDM4E (0.42) KMT2ALMNAOPRM1HRH4
SCHEMBL11068281 0.75 ALDH1A1 (0.43) MAPTPOLBKMT2ASMN1; SMN2SLC6A4
SCHEMBL11074405 0.75 OPRL1 (0.39) MAPTSMN1; SMN2OPRM1OPRD1HRH4

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-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