SCHEMBL15330692

SCHEMBL15330692

O=C(O)c1cccc2c1CC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
ALOX15 P16050 1/20 0.50
TRPA1 O75762 1/20 0.47
HSP90AA1 P07900 2/20 0.45
CXCR5 P32302 1/20 0.44
TSHR P16473 1/20 0.43
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
HMGB1 P09429 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA7 P43166 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL29950657 1.00 ALDH1A1 (0.50) ALDH1A1ALOX15TRPA1HSP90AA1CXCR5
SCHEMBL3613341 0.87 CXCR5 (0.53) ALDH1A1ALOX15TRPA1CXCR5KDM4E
SCHEMBL29493191 0.87 CXCR5 (0.56) ALDH1A1ALOX15TRPA1CXCR5GFER
SCHEMBL783869 0.87 CXCR5 (0.56) ALDH1A1ALOX15TRPA1CXCR5GFER
SCHEMBL5755502 0.85 CXCR5 (0.55) ALDH1A1ALOX15CXCR5GFER
Hydrochloric Acid SCHEMBL2398251 0.85 CXCR5 (0.55) ALDH1A1ALOX15CXCR5GFER
SCHEMBL16990754 0.83 ALDH1A1 (0.42) ALDH1A1ALOX15TRPA1HSP90AA1CXCR5
SCHEMBL242419 0.82 AKR1C3 (0.57) ALDH1A1CXCR5NR4A1KDM4EMAPT
SCHEMBL4915504 0.82 TRPA1 (0.56) ALDH1A1ALOX15TRPA1HSP90AA1TSHR
SCHEMBL11524733 0.82 AKR1B1 (0.56) ALDH1A1ALOX15TRPA1HSP90AA1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108218375-B Green and environment-friendly aerated concrete block and preparation method thereof 青岛广润丰建筑材料有限责任公司 2021-06-22 CN claimed
CN-116355182-B Modified epoxy resin composite material for ship-based display console, and preparation method and application thereof 北京航天天美科技有限公司 2023-08-04 CN disclosed
CN-116355182-A Modified epoxy resin composite material for ship-based display console, and preparation method and application thereof 北京航天天美科技有限公司 2023-06-30 CN disclosed
US-11518730-B2 Polymer compositions for self-assembly applications MERCK PATENT GMBH (DE) 2022-12-06 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-3500637-B1 POLYMER COMPOSITIONS FOR SELF-ASSEMBLY APPLICATIONS MERCK PATENT GMBH (DE) 2022-06-22 EP disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
CN-108218375-B Green and environment-friendly aerated concrete block and preparation method thereof 青岛广润丰建筑材料有限责任公司 2021-06-22 CN disclosed
CN-108218375-B Green and environment-friendly aerated concrete block and preparation method thereof 青岛广润丰建筑材料有限责任公司 2021-06-22 CN disclosed
CN-109715746-B Polymer compositions for self-assembling applications 默克专利有限公司 2021-03-26 CN disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-3500637-A1 POLYMER COMPOSITIONS FOR SELF-ASSEMBLY APPLICATIONS Ridgefield Acquisition (LU) 2019-06-26 EP disclosed
US-20190161570-A1 POLYMER COMPOSITIONS FOR SELF-ASSEMBLY APPLICATIONS AZ ELECTRONIC MATERIALS S.À R.L. (LU) 2019-05-30 US disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
WO-2018033559-A1 POLYMER COMPOSITIONS FOR SELF-ASSEMBLY APPLICATIONS AZ Electronic Materials (Luxembourg) S.à.r.l. (LU) 2018-02-22 WO disclosed
CN-102300462-B Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS INC 2015-01-28 CN disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
CN-102300462-A Inhibitors Of Hcv Ns5a 2011-12-28 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-11518730-B2 Polymer compositions for self-assembly applications PUF60, SMC4, PARG ALDH1A1 4442/4885ALOX15 3766/4885TRPA1 4744/4885

“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.