SCHEMBL20006770

SCHEMBL20006770

CCC(C)C1CCc2cc(F)ccc2C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.52
HTR1B P28222 1/20 0.52
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 3/20 0.36
DPP7 Q9UHL4 3/20 0.36
DPP4 P27487 2/20 0.36
PRMT5 O14744 1/20 0.36
ADRA2A P08913 2/20 0.36
ADRA2B P18089 2/20 0.36
ADRA2C P18825 2/20 0.36
SLC6A4 P31645 2/20 0.36
KCNH2 Q12809 4/20 0.35
HTR2C P28335 2/20 0.35
MCHR1 Q99705 2/20 0.35
OPRM1 P35372 3/20 0.35
OPRK1 P41145 3/20 0.35
MLNR O43193 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
HTR1A P08908 1/20 0.35

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
SCHEMBL23940661 0.87 HTR1D (0.48) HTR1DHTR1BDPP8DPP9DPP7
SCHEMBL23940696 0.87 HTR1D (0.48) HTR1DHTR1BDPP8DPP9DPP7
SCHEMBL24317059 0.84 HTR1D (0.49) HTR1DHTR1BPRMT5ADRA2AADRA2B
SCHEMBL20006885 0.84 HTR1D (0.51) HTR1DHTR1BDPP8DPP9DPP7
SCHEMBL20006880 0.77 HTR1D (0.45) HTR1DHTR1BPRMT5ADRA2AADRA2B
SCHEMBL20006982 0.76 HTR1D (0.49) HTR1DHTR1BDPP8DPP9DPP4
SCHEMBL19417849 0.74 ESR1 (0.46) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL13533180 0.73 SLC6A4 (0.43) HTR1DHTR1BDPP8DPP9DPP7
SCHEMBL7273416 0.72 HTR1D (0.40) HTR1DHTR1BDPP8DPP9DPP7
SCHEMBL2666215 0.72 HTR1D (0.54) HTR1DHTR1BKCNH2HTR2CMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3974419-A2 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) 2022-03-30 EP disclosed
EP-3299364-B1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO LTD (CN) 2021-10-20 EP disclosed
EP-3299364-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) 2018-03-28 EP disclosed