SCHEMBL754993

SCHEMBL754993

CCC(O)C1CCCN1C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 6/20 0.39
CHRNA3 P32297 6/20 0.39
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
UGT2B7 P16662 2/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
L3MBTL3 Q96JM7 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
SCHEMBL30467247 1.00 CHRNB4 (0.39) CHRNB4CHRNA3CHRNB2CHRNA4UGT2B7
SCHEMBL7278396 0.94 SLC6A2 (0.36) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL18194977 0.94 SLC6A2 (0.36) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL28185803 0.93 CHRNB4 (0.35) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL29174518 0.83 CHRNB4 (0.39) CHRNB4CHRNA3CHRNB2CHRNA4SLC6A2
SCHEMBL17286013 0.83 CHRNB4 (0.39) CHRNB4CHRNA3CHRNB2CHRNA4SLC6A2
SCHEMBL29174517 0.83 CHRNB4 (0.39) CHRNB4CHRNA3CHRNB2CHRNA4SLC6A2
SCHEMBL29300216 0.82 CHRNB4 (0.38) CHRNB4CHRNA3CHRNB2CHRNA4SLC6A2
SCHEMBL25984818 0.80 CHRNB4 (0.34) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL16902661 0.79 CHRNB4 (0.36) CHRNB4CHRNA3CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107427758-A Utilize the separation of ion liquid solvent 切弗朗菲利浦化学公司 2017-12-01 CN claimed
CN-109844069-A Utilize isobutane alkylation oil plant amylene 雪佛龙美国公司 2019-06-04 CN disclosed
CN-109642165-A Integrated coalescing system for separating liquid hydrocarbons from dispersed ionic liquid 雪佛龙美国公司 2019-04-16 CN disclosed
CN-108982403-A Integrated system and method for online monitoring of chemical concentration in ionic liquid 雪佛龙美国公司 2018-12-11 CN disclosed
CN-108473880-A Regeneration of acidic ionic liquid without adding hydrogenation catalyst 雪佛龙美国公司 2018-08-31 CN disclosed
CN-108014660-A It is continuously injected into the integrated system of a small amount of immiscible liquids 雪佛龙美国公司 2018-05-11 CN disclosed
CN-107427758-A Utilize the separation of ion liquid solvent 切弗朗菲利浦化学公司 2017-12-01 CN disclosed
US-8623881-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2014-01-07 US disclosed
US-8492389-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2013-07-23 US disclosed
US-8138195-B2 Inhibitors of human phosphatidylinositol 3-kinase delta ICOS CORPORATION (US) 2012-03-20 US disclosed
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-07-01 US disclosed
US-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION 2010-06-17 US disclosed
US-7320986-B2 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBOTT LABORTORIES (US) 2008-01-22 US disclosed
US-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBVIE INC. 2004-12-23 US disclosed
WO-2000073269-A2 NICOTINE RECEPTOR LIGANDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2000-12-07 WO 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 (3 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-20100152211-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CHRNB4 3838/4885CHRNA3 3851/4885CHRNB2 3729/4885
US-20100168139-A1 INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PIK3CG CHRNB4 3838/4885CHRNA3 3851/4885CHRNB2 3729/4885
US-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors TK1, MAP3K19, MAP3K20 CHRNB4 4532/4885CHRNA3 4412/4885CHRNB2 4478/4885

“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.