SCHEMBL616083

SCHEMBL616083

C=CCc1ccc2cc(OC)ccc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
CYP3A4 P08684 3/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
TP53 P04637 2/20 0.69
ALOX15 P16050 1/20 0.69
TSHR P16473 1/20 0.69
ALOX12 P18054 1/20 0.69
PPARG P37231 1/20 0.58
PPARD Q03181 1/20 0.58
PPARA Q07869 1/20 0.58
PTGS1 P23219 3/20 0.53
ALOX5 P09917 2/20 0.53
AKR1C3 P42330 1/20 0.53
AKR1C2 P52895 1/20 0.53
AR P10275 1/20 0.53
TRPM8 Q7Z2W7 1/20 0.53
MAPT P10636 3/20 0.50
CYP1A2 P05177 2/20 0.50
KDM4E B2RXH2 2/20 0.50
LMNA P02545 2/20 0.50

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
SCHEMBL3259762 0.84 XDH (0.58) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL3720728 0.83 PTGS1 (0.59) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
Estragole SCHEMBL900647 0.82 ALDH1A1 (1.00) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
Estragole SCHEMBL57204 0.82 ALDH1A1 (1.00) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
Estragole SCHEMBL28095175 0.82 ALDH1A1 (1.00) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
Estragole SCHEMBL28225206 0.80 ALDH1A1 (0.96) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
Estragole SCHEMBL29777399 0.80 ALDH1A1 (0.96) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL11746659 0.80 PTGS1 (0.56) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL7043823 0.80 XDH (0.54) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL11494827 0.80 XDH (0.54) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15

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-114057945-B Double-sheath steel strand cable suitable for photovoltaic flexible support and preparation method thereof 北京市建筑工程研究院有限责任公司 2023-06-20 CN claimed
CN-114057945-A Double-sheath steel strand cable suitable for photovoltaic flexible support and preparation method thereof 北京市建筑工程研究院有限责任公司 2022-02-18 CN claimed
CN-114057945-B Double-sheath steel strand cable suitable for photovoltaic flexible support and preparation method thereof 北京市建筑工程研究院有限责任公司 2023-06-20 CN disclosed
CN-114057945-A Double-sheath steel strand cable suitable for photovoltaic flexible support and preparation method thereof 北京市建筑工程研究院有限责任公司 2022-02-18 CN disclosed
CN-104956508-B Solution process organic semiconducting materials and organic semiconductor equipment 日本化药株式会社 2017-07-21 CN disclosed
CN-104956508-A ORGANIC SEMICONDUCTOR MATERIAL FOR SOLUTION PROCESS AND ORGANIC SEMICONDUCTOR DEVICE NIPPON KAYAKU KK 2015-09-30 CN disclosed
US-8981152-B2 Microwave induced single step green synthesis of some novel 2-aryl aldehydes and their analogues COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-03-17 US disclosed
US-20140197024-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-07-17 US disclosed
US-8779200-B2 Microwave induced single step green synthesis of some novel 2-aryl aldehydes and their analogues COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-07-15 US disclosed
US-20120041234-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGISTRATION OF SOCIETIES ACT (ACT XXI OF 1860)) (IN) 2012-02-16 US disclosed
WO-2010097811-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-09-02 WO disclosed
JP-2001039916-A HYDROGENATED NAPHTHALENE DAINIPPON INK & CHEM INC 2001-02-13 JP disclosed
JP-2000026342-A PHENYLETHYNYLNAPHTHALENE DERIVATIVE DAINIPPON INK & CHEM INC 2000-01-25 JP disclosed
US-4119558-A PHENYL, NAPHTHYL DIESTERS OF CHLOROBENZENE DICARBOXYLIC ACID THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1978-10-10 US disclosed
US-4113647-A ELECTRO-OPTIC DISPLAY DEVICE THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1978-09-12 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 (2 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-20140197024-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES WFS1, EPHX2, MANBA ALDH1A1 36/4885CYP3A4 907/4885SMN1; SMN2 4560/4885
US-20120041234-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES AADAC, NAT1, CTRB1 ALDH1A1 2216/4885CYP3A4 344/4885SMN1; SMN2 4324/4885

“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.