SCHEMBL15475280

SCHEMBL15475280

C[Si](C)(C)O[Si](C)(C)C.OC[C@@]1(c2ccccc2)CCCN1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFB P00751 1/20 0.36
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CYP3A4 P08684 3/20 0.34
CYP2C19 P33261 3/20 0.34
TSHR P16473 2/20 0.34
FFAR1 O14842 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
SLC6A9 P48067 1/20 0.33
HSD11B1 P28845 3/20 0.33
GAA P10253 1/20 0.32
ALDH1A1 P00352 3/20 0.32
CYP1A2 P05177 2/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
SIGMAR1 Q99720 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL1447192 1.00 CFB (0.36) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
Methoxymethane SCHEMBL3450929 0.89 NR1H2 (0.40) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
SCHEMBL29908655 0.89 CFB (0.39) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
SCHEMBL606913 0.89 CFB (0.39) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
SCHEMBL246216 0.89 CFB (0.39) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
SCHEMBL606912 0.89 CFB (0.39) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
SCHEMBL27866641 0.87 CFB (0.38) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
Hydrochloric Acid SCHEMBL28274724 0.87 CFB (0.38) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
Hydrochloric Acid SCHEMBL8207460 0.87 CFB (0.38) CFBNR1H2NR1H3SMN1; SMN2CYP3A4
SCHEMBL28282470 0.87 CFB (0.38) CFBNR1H2NR1H3SMN1; SMN2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102838526-B Preparation method of chiral Beta-indolyl-Gamma-aldehyde group nitro alkanes UNIV SOOCHOW 2015-04-08 CN claimed
CN-102838526-A Preparation method of chiral Beta-indolyl-Gamma-aldehyde group nitro alkanes UNIV SOOCHOW 2012-12-26 CN claimed
CN-101863815-A Synthesis method of cis 3-phenyl substituted s-proline derivative JIAXING EPOCHEM PHARMTECH CO LTD 2010-10-20 CN claimed
CN-110498808-B Intermediate for synthesizing (2S,3R) -3-substituted phenyl pyrrolidine-2-carboxylic acid and preparation method and application thereof 浙江晖石药业有限公司 2021-11-05 CN disclosed
CN-110498808-A A kind of intermediate and its preparation method and application synthesizing (2S, 3R) -3- substituted-phenyl pyrrolidines -2- carboxylic acid ZHEJIANG HUISHI PHARMACEUTICAL CO LTD 2019-11-26 CN disclosed
EP-2703381-B1 METHOD FOR PRODUCING FIVE-MEMBERED RING-CONTAINING COMPOUND ONO PHARMACEUTICAL CO (JP) 2015-10-21 EP disclosed
CN-102838526-B Preparation method of chiral Beta-indolyl-Gamma-aldehyde group nitro alkanes UNIV SOOCHOW 2015-04-08 CN disclosed
CN-102838526-B Preparation method of chiral Beta-indolyl-Gamma-aldehyde group nitro alkanes UNIV SOOCHOW 2015-04-08 CN disclosed
US-8716500-B2 Method for producing five-membered ring-containing compound ONO PHARMACEUTICAL CO., LTD. (JP) 2014-05-06 US disclosed
EP-2703381-A1 METHOD FOR PRODUCING FIVE-MEMBERED RING-CONTAINING COMPOUND Ono Pharmaceutical Co., Ltd. (JP) 2014-03-05 EP disclosed
US-20140051874-A1 METHOD FOR PRODUCING FIVE-MEMBERED RING-CONTAINING COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2014-02-20 US disclosed
CN-101914051-B Synthesis method of 3-phenyl pyrroline derivatives with optical isomerism purity JIAXING EPOCHEM PHARMTECH CO LTD 2013-03-13 CN disclosed
CN-102838526-A Preparation method of chiral Beta-indolyl-Gamma-aldehyde group nitro alkanes UNIV SOOCHOW 2012-12-26 CN disclosed
CN-102838526-A Preparation method of chiral Beta-indolyl-Gamma-aldehyde group nitro alkanes UNIV SOOCHOW 2012-12-26 CN disclosed
CN-101914051-A Synthesis method of 3-phenyl pyrroline derivatives with optical isomerism purity JIAXING EPOCHEM PHARMTECH CO LTD 2010-12-15 CN disclosed
CN-101863815-A Synthesis method of cis 3-phenyl substituted s-proline derivative JIAXING EPOCHEM PHARMTECH CO LTD 2010-10-20 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140051874-A1 METHOD FOR PRODUCING FIVE-MEMBERED RING-CONTAINING COMPOUND PTGIS, ALOX5, PTGES CFB 3033/4885NR1H2 280/4885NR1H3 405/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.