Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TASP1 | Q9H6P5 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11323181 | 1.00 | CYP3A4 (0.47) | CYP3A4ALDH1A1TSHRTDP1ESR1 | |
| SCHEMBL97582 | 0.89 | CA1 (0.52) | CYP3A4ALDH1A1TSHRTDP1ESR1 | |
| SCHEMBL24715430 | 0.88 | CALM1 (0.67) | ALDH1A1CA1CA2CALM1CYP2C9 | |
| SCHEMBL8992968 | 0.88 | IDO1 (0.48) | ALDH1A1ESR1ESR2CA1CA2 | |
| SCHEMBL4426841 | 0.88 | CALM1 (0.67) | ALDH1A1CA1CA2CALM1CYP2C9 | |
| SCHEMBL8993222 | 0.86 | IDO1 (0.46) | CYP3A4ALDH1A1TSHRTDP1ESR1 | |
| SCHEMBL10565351 | 0.86 | TAAR1 (0.43) | CYP3A4ALDH1A1TSHRTDP1ESR1 | |
| SCHEMBL10564566 | 0.86 | IDO1 (0.46) | CYP3A4ALDH1A1TSHRTDP1ESR1 | |
| SCHEMBL5511243 | 0.80 | SRD5A2 (0.50) | ALDH1A1KMT2AKDM4ELTA4HIDH1 | |
| SCHEMBL9161636 | 0.80 | LOXL2 (0.54) | ALDH1A1CA2CA6IDH1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4259460-A | BLENDS OF POLYMERS OF VINYL CHLORIDE, ACRYLONITRILE-BUTADIENE, AND BUTADIENE-STYRENE-TERTIARY AMINE | POLYSAR LIMITED (CA) | 1981-03-31 | — | — | US | claimed |
| CN-110669219-B | Sulfur-containing polymer and preparation method and application thereof | 东北师范大学 | 2021-05-18 | — | — | CN | disclosed |
| CN-110669219-A | Sulfur-containing polymer and preparation method and application thereof | 东北师范大学 | 2020-01-10 | — | — | CN | disclosed |
| US-7030171-B2 | Process for producing vinyl polymer having functional group at end and vinyl polymer having functional group at end | SEKISUI CHEMICAL CO., LTD. (JP) | 2006-04-18 | — | — | US | disclosed |
| EP-1311499-B1 | BICYCLIC COMPOUNDS AS H3 RECEPTOR LIGANDS | ORTHO MCNEIL PHARM INC (US) | 2006-04-12 | — | — | EP | disclosed |
| US-20040092619-A1 | Process for producing vinyl polymer having functional group at end and vinyl polymer having functional group at end | WAKIYA TAKESHI (JP) | 2004-05-13 | — | — | US | disclosed |
| US-6693142-B1 | POLYMERIZATION REACTION OF VINYL MONOMERS IN PRESENCE OF HALOGEN COMPOUND AND SUBSTITUTING WITH SUCH AS HYDROXYL, AMINO, VINYL OR SILYL GROUPS | SEKISUI CHEMICAL CO., LTD. (JP) | 2004-02-17 | — | — | US | disclosed |
| US-6638967-B2 | Pyrrole, furan, thiofuran and phenyl derivatives; inhibition of histamine H3 receptor activity; for example, 1-((4-(4-Pyrrolidin-1-ylmethyl-phenyl)-thien-2-yl)methyl)-pyrrolidine | ORTHO-MCNEIL PHAMRACEUTICAL, INC. | 2003-10-28 | — | — | US | disclosed |
| EP-1311499-A2 | BICYCLIC COMPOUNDS AS H3 RECEPTOR LIGANDS | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-05-21 | — | — | EP | disclosed |
| EP-1243599-A1 | PROCESS FOR PRODUCING VINYL POLYMER HAVING FUNCTIONAL GROUP AT END AND VINYL POLYMER HAVING FUNCTIONAL GROUP AT END | SEKISUI CHEMICAL CO., LTD. (JP) | 2002-09-25 | — | — | EP | disclosed |
| US-20020037896-A1 | Pyrrole, furan, thiofuran and phenyl derivatives; inhibition of histamine H3 receptor activity; for example, 1-((4-(4-Pyrrolidin-1-ylmethyl-phenyl)-thien-2-yl)methyl)-pyrrolidine | ORTHO MCNEIL PHARMACEUTICAL, INC. | 2002-03-28 | — | — | US | disclosed |
| WO-2002012224-A2 | BICYCLIC COMPOUNDS AS H3 RECEPTOR LIGANDS | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2002-02-14 | — | — | WO | disclosed |
| EP-0696585-B1 | NOVEL BISOXADIAZOLIDINE DERIVATIVE | YAMANOUCHI PHARMA CO LTD (JP) | 1998-12-16 | — | — | EP | disclosed |
| US-5643931-A | ANTIDIABETIC AGENTS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1997-07-01 | — | — | US | disclosed |
| EP-0696585-A1 | NOVEL BISOXADIAZOLIDINE DERIVATIVE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-02-14 | — | — | EP | disclosed |
| US-4259460-A | BLENDS OF POLYMERS OF VINYL CHLORIDE, ACRYLONITRILE-BUTADIENE, AND BUTADIENE-STYRENE-TERTIARY AMINE | POLYSAR LIMITED (CA) | 1981-03-31 | — | — | US | disclosed |
| US-4130579-A | Bis(2-methyl-2-cyanopropyl) aromatics | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1978-12-19 | — | — | US | disclosed |
| US-3947471-A | CHROMOGENIC | SUMITOMO CHEMICAL COMPANY, LTD. (JA) | 1976-03-30 | — | — | US | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20020037896-A1 | Pyrrole, furan, thiofuran and phenyl derivatives; inhibition of histamine H3 receptor activity; for example, 1-((4-(4-Pyrrolidin-1-ylmethyl-phenyl)-thien-2-yl)methyl)-pyrrolidine | HRH4, HRH3, HRH2 | CYP3A4 1347/4885ALDH1A1 1225/4885TSHR 318/4885 |
“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.