SCHEMBL16588653

SCHEMBL16588653

O=C1CCC(N(c2ccccc2)c2ccccc2)CO1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
HTT P42858 1/20 0.34
CTRB1 P17538 1/20 0.33
CYP2D6 P10635 2/20 0.33
CCR5 P51681 2/20 0.32
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
KCNA3 P22001 1/20 0.32
CYP3A4 P08684 1/20 0.31
LMNA P02545 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
MITF O75030 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
PAX8 Q06710 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL14741786 0.92 CYP2D6 (0.38) SLC6A2SLC6A4HTTCYP2D6CCR5
SCHEMBL14741940 0.90 KCNA3 (0.39) SLC6A2SLC6A4HTTCYP2D6CCR5
SCHEMBL16588792 0.85 CA1 (0.35) SLC6A2SLC6A4CTRB1CCR5OPRM1
SCHEMBL16588803 0.84 CTRB1 (0.33) HTTCTRB1CYP2D6CYP3A4
SCHEMBL16588655 0.82 CRHBP (0.36) SLC6A2SLC6A4HTTCYP2D6CCR5
SCHEMBL14741953 0.82 CA1 (0.41) SLC6A2SLC6A4CTRB1CCR5KCNA3
SCHEMBL16588777 0.79 CTRB1 (0.32) CTRB1
SCHEMBL16588672 0.77 KCNA3 (0.39) SLC6A2SLC6A4CYP2D6CCR5KCNA3
SCHEMBL16588823 0.76 CYP2D6 (0.38) HTTCYP2D6KCNA3CYP3A4KDM4E
SCHEMBL21047840 0.76 SLC6A2 (0.39) SLC6A2SLC6A4HTTCCR5OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993683-B2 Polymers functionalized with lactones or thiolactones containing a protected amino group BRIDGESTONE CORPORATION (JP) 2015-03-31 US claimed
CN-103857704-A Polymers functionalized with lactones or thiolactones containing a protected amino group BRIDGESTONE CORP 2014-06-11 CN claimed
CN-103857704-B By the lactone containing shielded amino or the functionalized polymkeric substance of thiolactone BRIDGESTONE CO.,LTD. (JP) 2016-02-17 CN disclosed
EP-2751142-B1 POLYMERS FUNCTIONALIZED WITH LACTONES OR THIOLACTONES CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORP (JP) 2015-12-09 EP disclosed
US-8993683-B2 Polymers functionalized with lactones or thiolactones containing a protected amino group BRIDGESTONE CORPORATION (JP) 2015-03-31 US disclosed
CN-103857704-A Polymers functionalized with lactones or thiolactones containing a protected amino group BRIDGESTONE CORP 2014-06-11 CN disclosed