SCHEMBL5002160

SCHEMBL5002160

CC=CCc1ccc(OC)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
TP53 P04637 2/20 0.61
CYP3A4 P08684 2/20 0.61
TSHR P16473 2/20 0.61
ALOX15 P16050 1/20 0.61
ALOX12 P18054 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
IDO1 P14902 5/20 0.57
AGXT P21549 2/20 0.57
TAAR1 Q96RJ0 1/20 0.52
SLC6A4 P31645 1/20 0.48
LMNA P02545 1/20 0.48
KDM4E B2RXH2 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
MAOB P27338 2/20 0.47

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
SCHEMBL12924871 1.00 ALDH1A1 (0.61) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL11437812 0.89 ALDH1A1 (0.68) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL3933929 0.82 ALDH1A1 (0.65) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL28743541 0.81 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL7921584 0.81 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL16093275 0.81 ACHE (0.62) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL1741564 0.81 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL6258400 0.81 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL5598799 0.81 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4TSHRALOX15
SCHEMBL6803104 0.81 ALDH1A1 (0.64) ALDH1A1TP53CYP3A4TSHRALOX15

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-114667618-A Separator, fuel cell, and method for manufacturing separator 罗伯特·博世有限公司 2022-06-24 CN disclosed
CN-111868111-A Molded article comprising polar olefin polymer and physical properties thereof 国立研究开发法人理化学研究所 2020-10-30 CN disclosed
CN-105585467-B A kind of novel preparation method of anisyl propionaldehyde 上海应用技术学院 2017-08-25 CN disclosed
CN-104817444-B A kind of preparation method of anisyl propionaldehyde 上海应用技术学院 2016-08-24 CN disclosed
CN-105585467-A Novel preparation method of anisyl propanal SHANGHAI INST TECHNOLOGY 2016-05-18 CN disclosed
US-9309188-B2 Method for allylating and vinylating aryl, heteroaryl, alkyl, and alkene halogenides using transition metal catalysis Saitigo GmbH (DE) 2016-04-12 US disclosed
CN-104817444-A Preparation method of anisyl propionaldehyde SHANGHAI INST TECHNOLOGY 2015-08-05 CN disclosed
CN-101308329-B Coating compositions ROHM & HAAS ELECT MAT 2013-09-04 CN disclosed
US-20130184485-A1 Method for Allylating and Vinylating Aryl, Heteroaryl, Alkyl, and Alkene Halogenides Using Transition Metal Catalysis SALTIGO GMBH (DE) 2013-07-18 US disclosed
CN-100439378-C Phospinite-imidazolines and metal complexes thereof SOLVIAS AG (CH) 2008-12-03 CN disclosed
CN-101308329-A Coating compositions ROHM & HAAS ELECT MAT (US) 2008-11-19 CN disclosed
US-20080248331-A1 Coating composition ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2008-10-09 US disclosed
CN-1842533-A Phospinite-imidazolines and metal complexes thereof SOLVIAS AG (CH) 2006-10-04 CN disclosed
US-5466838-A Catalytic reaction of olefin with oxygen in the presence of aldehyde SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-11-14 US disclosed
EP-0540009-B1 Process for producing epoxides SUMITOMO CHEMICAL CO (JP) 1995-08-30 EP disclosed
US-5367087-A Process for producing epoxide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0540009-A1 Process for producing epoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-05 EP disclosed
CN-87100040-A The alkylamine that alkyl diaryl replaces, its preparation technology's method, the medicine of using and containing this compounds 1987-09-16 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-20130184485-A1 Method for Allylating and Vinylating Aryl, Heteroaryl, Alkyl, and Alkene Halogenides Using Transition Metal Catalysis VRK2, VRK1, GRK1 ALDH1A1 2413/4885TP53 4677/4885CYP3A4 386/4885

“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.