SCHEMBL30949014

SCHEMBL30949014

CCCCCCc1ccc(C(O)CCCCC)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.58
ADRA2A P08913 2/20 0.58
ADORA3 P0DMS8 2/20 0.58
TACR2 P21452 2/20 0.58
SLC6A2 P23975 2/20 0.58
SLC6A4 P31645 2/20 0.58
SLC6A3 Q01959 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
SHBG P04278 1/20 0.58
TP53 P04637 1/20 0.58
CYP3A4 P08684 1/20 0.58
HSPD1 P10809 1/20 0.58
ADRB3 P13945 1/20 0.58
HTR2C P28335 1/20 0.58
HSPE1 P61604 1/20 0.58
HIF1A Q16665 1/20 0.58
TST Q16762 1/20 0.58
HSD17B10 Q99714 1/20 0.58

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
SCHEMBL2723602 0.91 ESR1 (0.53) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9501922 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9498512 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9498144 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9499420 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9499018 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL903623 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9499281 0.89 ESR1 (0.58) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9453929 0.88 CYSLTR2 (0.61) ALDH1A1S1PR2S1PR1S1PR3CYSLTR2
SCHEMBL8386789 0.87 ESR1 (0.56) ESR1ADRA2AADORA3TACR2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118218603-A Preparation method of superfine copper powder with strong oxidation resistance 华东理工大学 2024-06-21 CN disclosed