SCHEMBL266195

SCHEMBL266195

COc1ccc(CC(C)N)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.59
CA2 P00918 1/20 0.59
ALOX15 P16050 1/20 0.58
ALOX12 P18054 1/20 0.58
SLC6A4 P31645 1/20 0.58
TAAR1 Q96RJ0 2/20 0.58
HTR2A P28223 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ATM Q13315 1/20 0.56

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
SCHEMBL3371646 1.00 LDHA (0.59) LDHACA2ALOX15ALOX12SLC6A4
SCHEMBL2564908 1.00 LDHA (0.59) LDHACA2ALOX15ALOX12SLC6A4
SCHEMBL31545634 1.00 LDHA (0.59) LDHACA2ALOX15ALOX12SLC6A4
SCHEMBL31545527 1.00 LDHA (0.59) LDHACA2ALOX15ALOX12SLC6A4
Hydrochloric Acid SCHEMBL31545361 0.98 LDHA (0.57) LDHACA2ALOX15ALOX12SLC6A4
Hydrochloric Acid SCHEMBL8621694 0.98 LDHA (0.57) LDHACA2ALOX15ALOX12SLC6A4
Hydrochloric Acid SCHEMBL8867271 0.98 LDHA (0.57) LDHACA2ALOX15ALOX12SLC6A4
SCHEMBL5304484 0.88 CALM1 (0.55) SLC6A4TAAR1KDM4E
SCHEMBL5304491 0.88 CALM1 (0.55) SLC6A4TAAR1KDM4E
SCHEMBL8635083 0.86 ATM (0.74) CA2KDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4061359-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH Turtle Bear Holdings, LLC (US) 2022-09-28 EP claimed
WO-2021101926-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH STAMETS PAUL EDWARD (US) 2021-05-27 WO claimed
US-20210145851-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH TURTLE BEAR HOLDINGS, LLC 2021-05-20 US claimed
US-20210069170-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH TURTLE BEAR HOLDINGS, LLC 2021-03-11 US claimed
CN-107298655-A 7,8 dimethoxy 2,3,4,5 tetrahydrochysene 1H benzos [c] azatropylidene hydrochloride and preparation method thereof 郑州轻工业学院 2017-10-27 CN claimed
EP-2623593-B1 NOVEL AMINOTRANSFERASE AND GENE ENCODING SAME, AND USE OF THE AMINOTRANSFERASE AND THE GENE KANEKA CORP (JP) 2017-07-12 EP claimed
EP-2684953-B1 MODIFIED AMINOTRANSFERASE, GENE THEREOF, AND METHOD FOR PRODUCING OPTICALLY ACTIVE AMINO COMPOUND USING SAME KANEKA CORP (JP) 2017-06-28 EP claimed
EP-2623595-B1 NOVEL TRANSAMINASE SHOWING HIGH ACTIVITY FOR GLUTAMIC ACID, GENE ENCODING SAME, AND METHOD FOR UTILIZATION THEREOF KANEKA CORP (JP) 2016-11-02 EP claimed
US-9481870-B2 Nucleic acid encoding a polypeptide having aminotransferase activity, vectors and host cells comprising the nucleic acid KANEKA CORPORATION (JP) 2016-11-01 US claimed
WO-2016065425-A1 BIOTRANSFORMATION REACTIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-05-06 WO claimed
EP-2623593-A1 NOVEL AMINOTRANSFERASE AND GENE ENCODING SAME, AND USE OF THE AMINOTRANSFERASE AND THE GENE Kaneka Corporation (JP) 2013-08-07 EP claimed
US-20130196389-A1 NOVEL TRANSAMINASE EXHIBITING HIGH ACTIVITY FOR GLUTAMIC ACID, GENE ENCODING SAME, AND METHOD FOR USING THEM KANEKA CORPORATION (JP) 2013-08-01 US claimed
EP-0848065-B1 Method for improving optical purity of an amine compound SUMITOMO CHEMICAL CO (JP) 2003-04-02 EP claimed
EP-0987332-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINO COMPOUNDS Kaneka Corporation (JP) 2000-03-22 EP claimed
US-5965432-A PREFERENTIALLY METABOLIZING (S) ENANTOMORPH OF MIXTURE USING CULTURE OF ARTHROBACTER, CULTURE LIQUID, GEL IMMOBILIZED CELLS, FREEZE-DRIED OR ACETONE-DRIED CELLS, GROUND OR AUTODIGESTED CELLS, ULTRASONIC TREATED OR EXTRACTED CELLS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-10-12 US claimed
EP-0848065-A2 Method for improving optical purity of an amine compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-06-17 EP claimed
US-5360724-A Process for the preparation of chiral 1-aryl-2-aminopropanes CELGENE CORPORATION (US) 1994-11-01 US claimed
US-4847403-A 2-Isopropyl-2-(2-methylphenyl)-5-(N-methyl-N-homoveratrylamino)-valeronitrile and method for producing same SPOFA, SPOJENE PODNIKY PRO ZDRAVOTNICKOU (CS) 1989-07-11 US claimed
EP-0257768-A1 2-Isopropyl-2-phenyl-5-(N-methyl-2-phenylethylamino)-valeronitrile derivatives and processes for their preparation SPOFA Spojené Podniky Pro Zdravotnickou Vyrobu (CS) 1988-03-02 EP claimed
EP-0142070-B1 PROCESS FOR THE PREPARATION OF N-METHYLHOMOVERATRYL AMINE BASF Aktiengesellschaft (DE) 1986-07-09 EP claimed

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-20210145851-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH HTR1B, HTR6, BDNF LDHA 4842/4885CA2 3926/4885ALOX15 3893/4885
US-20210069170-A1 TRYPTAMINE COMPOSITIONS FOR ENHANCING NEURITE OUTGROWTH HTR1B, HTR6, BDNF LDHA 4842/4885CA2 3926/4885ALOX15 3893/4885

“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.