SCHEMBL2063957

SCHEMBL2063957

Oc1ccc(C2CO2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.56
▸ ESR2 Q92731 9/20 0.48
▸ ESR1 P03372 3/20 0.44
▸ NPC1 O15118 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ GMNN O75496 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CA3 P07451 1/20 0.42
▸ TYR P14679 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ NFKB1 P19838 1/20 0.42

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
SCHEMBL2063039 1.00 TSHR (0.56) TSHRESR2ESR1NPC1CYP3A4
Phenol SCHEMBL2208770 0.91 TSHR (0.67) TSHRESR2NPC1CYP3A4MAPT
SCHEMBL46155 0.86 TSHR (0.72) TSHRALOX5
SCHEMBL7606736 0.85 TSHR (0.59) TSHRESR2ESR1NPC1CYP3A4
SCHEMBL14185372 0.84 CHRM2 (0.50) TSHRESR2NPC1CYP3A4MAPT
SCHEMBL29000962 0.80 ESR2 (0.50) ESR2ESR1NPC1CYP3A4MAPT
SCHEMBL1696497 0.80 ESR2 (0.42) ESR2ESR1NPC1CYP3A4MAPT
SCHEMBL12906517 0.80 ESR2 (0.41) TSHRESR2ESR1NPC1CYP3A4
SCHEMBL13606167 0.80 ESR2 (0.53) TSHRESR2ESR1CYP3A4MAPT
SCHEMBL29776949 0.78 KDM1A (0.42) TSHRESR2ESR1NPC1CYP3A4

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112878046-A Pretreatment liquid for dipping aramid fiber hard cord and dipping method of aramid fiber hard cord 青岛天邦线业有限公司 2021-06-01 — — CN claimed
US-20090311760-A1 HOST CELLS AND USES THEREOF IN THE MICROBIAL PRODUCTION OF HYDROXYLATED AROMATICS SCHOEMAKERSTRAAT 97 (NL) 2009-12-17 — — US claimed
EP-2032711-A1 HOST CELLS AND USES THEREOF IN THE MICROBIAL PRODUCTION OF HYDROXYLATED AROMATICS Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) 2009-03-11 — — EP claimed
WO-2007133084-A1 HOST CELLS AND USES THEREOF IN THE MICROBIAL PRODUCTION OF HYDROXYLATED AROMATICS NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2007-11-22 — — WO claimed
EP-0454004-B1 Polyarylate and process for preparing the same KANEGAFUCHI CHEMICAL IND (JP) 1996-07-24 — — EP claimed
CN-110343443-B Graphene coating and preparation method thereof 宜昌三峡中润纳米材料有限公司 2021-12-07 — — CN disclosed
US-20170320834-A1 TRIAZABUTADIENES AS CLEAVABLE CROSS-LINKERS THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2017-11-09 — — US disclosed
US-9593080-B1 Triazabutadienes as cleavable cross-linkers THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2017-03-14 — — US disclosed
US-9458143-B1 Triazabutadienes as additives in adhesive systems THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2016-10-04 — — US disclosed
US-9458143-B1 Triazabutadienes as additives in adhesive systems THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2016-10-04 — — US disclosed
EP-1939268-B1 LIGHT-MODULATING LIQUID-CRYSTAL ELEMENT ADEKA CORP (JP) 2012-11-07 — — EP disclosed
US-8148118-B2 Method of inducing chirality to epoxides using 2,3:4,6 di-O-isopropylidene-2-keto-L-gulonic acid monohydrate COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-04-03 — — US disclosed
EP-0204948-B1 GROWTH PROMOTION OF ANIMALS WITH PHENETHANOL AMINES ELI LILLY AND COMPANY (US) 1990-03-28 — — EP disclosed
EP-0343907-A2 Process for making stable polymer polyols using epoxy resin-modified polyols as base polyols ARCO Chemical Technology, L.P. (US) 1989-11-29 — — EP disclosed
US-4849453-A ANIMAL GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1989-07-18 — — US disclosed
US-4734437-A PHENETHANOLAMINES ELI LILLY AND COMPANY (US) 1988-03-29 — — US disclosed
US-4690951-A B-PHENETHANGLAMINES; FEED EFFICIENCY AND LEANESS ELI LILLY AND COMPANY (US) 1987-09-01 — — US disclosed
EP-0204948-A1 Growth promotion of animals with phenethanol amines ELI LILLY AND COMPANY (US) 1986-12-17 — — EP disclosed
US-4497964-A CARBONYLATION, HYDROGENATION SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-02-05 — — US disclosed
EP-0117647-A1 Improvements in or relating to phenethanolamines ELI LILLY AND COMPANY (US) 1984-09-05 — — EP 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-20170320834-A1 TRIAZABUTADIENES AS CLEAVABLE CROSS-LINKERS WRN, TNKS, JMJD7 TSHR 2008/4885ESR2 2960/4885ESR1 996/4885

“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.

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