SCHEMBL28040715

SCHEMBL28040715

C[Si](C)([SnH])c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
TSHR P16473 4/20 0.35
LMNA P02545 1/20 0.35
ALOX12 P18054 1/20 0.35
ACHE P22303 1/20 0.35
MAPT P10636 1/20 0.34
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
NOTUM Q6P988 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
CYP1A2 P05177 1/20 0.31
NQO2 P16083 1/20 0.31
CES2 O00748 1/20 0.31

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
SCHEMBL2169977 0.73 ESR1 (0.48) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL92396 0.73 ESR1 (0.48) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL239179 0.73 ESR1 (0.48) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL63526 0.73 ESR1 (0.70) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL439492 0.73 ESR1 (0.48) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL28415835 0.71 ESR1 (0.46) ESR1ESR2NR1H2NR1H3TSHR
Phosphine SCHEMBL28991719 0.71 ESR1 (0.46) ESR1ESR2NR1H2NR1H3TSHR
Methane SCHEMBL28815257 0.71 ESR1 (0.46) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL12191039 0.71 ESR1 (0.75) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL7768857 0.71 ESR1 (0.46) ESR1ESR2NR1H2NR1H3TSHR

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
CN-105418567-B The production method of beraprost 琅歌生物技术股份有限公司 2019-09-06 CN disclosed
CN-105315247-B The production method of beraprost 琅歌生物技术股份有限公司 2019-07-26 CN disclosed
CN-107406468-A Silicone-modified photoinitiators and photocurable adhesive compositions thereof 汉高股份有限及两合公司 2017-11-28 CN disclosed
CN-105418567-A METHOD OF PRODUCING BERAPROST Lung LLC 2016-03-23 CN disclosed
CN-105315247-A METHOD OF PRODUCING BERAPROST Lung LLC 2016-02-10 CN disclosed
CN-103717585-B Method for producing beraprost LUNG BIOTECHNOLOGY PBC (US) 2015-11-25 CN disclosed