SCHEMBL313519

SCHEMBL313519

C=C(C)[CH]c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.43
▸ TSHR P16473 2/20 0.43
▸ AKR1C3 P42330 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ CYP3A4 P08684 1/20 0.42
▸ ALOX15 P16050 1/20 0.40
▸ FBP1 P09467 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ RECQL P46063 2/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ TNKS O95271 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.36
▸ HDAC7 Q8WUI4 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL11573032 0.78 ALDH1A1 (0.48) ALDH1A1TSHRAKR1C3GLATDP1
SCHEMBL21268022 0.78 ALDH1A1 (0.46) ALDH1A1TSHRAKR1C3GLATDP1
SCHEMBL9397943 0.77 ESR1 (0.46) ALDH1A1TDP1CYP3A4ALOX15MAOB
SCHEMBL1681787 0.77 AKR1C3 (0.47) ALDH1A1TSHRAKR1C3GLATDP1
Styrene SCHEMBL23291090 0.75 ALDH1A1 (0.67) ALDH1A1TSHRAKR1C3GLATDP1
SCHEMBL489257 0.75 GLA (0.61) ALDH1A1TSHRGLATDP1CYP3A4
Styrene SCHEMBL5914572 0.75 ALDH1A1 (0.67) ALDH1A1TSHRAKR1C3GLATDP1
SCHEMBL11185426 0.75 GLA (0.61) ALDH1A1TSHRGLATDP1CYP3A4
Styrene SCHEMBL530074 0.75 ALDH1A1 (0.67) ALDH1A1TSHRAKR1C3GLATDP1
Styrene SCHEMBL1408424 0.75 ALDH1A1 (0.67) ALDH1A1TSHRAKR1C3GLATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3137529-B1 PROCESS FOR MAKING A POLYMER POLYOL BASF SE (DE) 2020-06-17 — — EP claimed
US-10370479-B2 Process for making a polymer polyol BASF SE (DE) 2019-08-06 — — US claimed
EP-3137529-A1 PROCESS FOR MAKING A POLYMER POLYOL BASF SE (DE) 2017-03-08 — — EP claimed
US-20170044297-A1 PROCESS FOR MAKING A POLYMER POLYOL BASF SE (DE) 2017-02-16 — — US claimed
WO-2015165761-A1 PROCESS FOR MAKING A POLYMER POLYOL BASF SE (DE) 2015-11-05 — — WO claimed
EP-2786985-A2 Antagonists of the glucagon receptor Metabasis Therapeutics, Inc. (US) 2014-10-08 — — EP claimed
EP-2129654-A1 NOVEL ANTAGONISTS OF THE GLUCAGON RECEPTOR Metabasis Therapeutics, Inc. (US) 2009-12-09 — — EP claimed
WO-2008098244-A1 NOVEL ANTAGONISTS OF THE GLUCAGON RECEPTOR METABASIS THERAPEUTICS, INC. (US) 2008-08-14 — — WO claimed
EP-1506240-A1 GRAFT POLYOLS PREPARED BY A CONTINUOUS PROCESS BASF CORPORATION (US) 2005-02-16 — — EP claimed
WO-2003097710-A1 GRAFT POLYOLS PREPARED BY A CONTINUOUS PROCESS BASF CORPORATION (US) 2003-11-27 — — WO claimed
US-6090902-A Organopolysiloxane-modified graft copolymers DOW CORNING CORPORATION (US) 2000-07-18 — — US claimed
EP-1013681-A1 Organopolysiloxane-modified graft copolymers DOW CORNING CORPORATION (US) 2000-06-28 — — EP claimed
EP-0185872-B1 1-PHENYL-2-METHYL-3-HYDROXY-(3-ACYLOXY)-ALKYL COMPOUNDS AND THEIR USE AS PERFUMES BASF Aktiengesellschaft (DE) 1990-02-07 — — EP claimed
JP-2000562-A — — None — — JP disclosed
US-12017980-B2 Monofunctional phenolic compound, active ester resin and method for producing the same, and thermosetting resin composition and cured product thereof DIC CORPORATION (JP) 2024-06-25 — — US disclosed
CN-118185233-A Resin composition 味之素株式会社 2024-06-14 — — CN disclosed
EP-0323082-A2 Catalysts IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-07-05 — — EP disclosed
EP-0250090-A2 Storage stable latently curable acrylic formulations employing polymeric hydroperoxides LOCTITE CORPORATION (US) 1987-12-23 — — EP disclosed
EP-0185872-A1 1-Phenyl-2-methyl-3-hydroxy-(3-acyloxy)-alkyl compounds and their use as perfumes BASF Aktiengesellschaft (DE) 1986-07-02 — — EP disclosed
US-4020005-A Gelled reagent materials LANG JOHN L 1977-04-26 — — 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-12017980-B2 Monofunctional phenolic compound, active ester resin and method for producing the same, and thermosetting resin composition and cured product thereof JMJD7, KDM7A, KDM4A ALDH1A1 474/4885TSHR 4809/4885AKR1C3 2310/4885

“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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