SCHEMBL21045256

SCHEMBL21045256

Cn1c(CCCNC(=O)NC2CCOCC2)nnc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 5/20 0.47
MFN2 O95140 1/20 0.43
OPRM1 P35372 2/20 0.42
OPRL1 P41146 2/20 0.42
GAA P10253 2/20 0.41
RGS12 O14924 1/20 0.41
EPHX2 P34913 2/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
BRD4 O60885 2/20 0.38
GABRA5 P31644 3/20 0.38

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
SCHEMBL22404721 0.89 EPHX1 (0.47) EPHX1MFN2OPRM1OPRL1GAA
SCHEMBL21045281 0.86 MFN2 (0.50) EPHX1MFN2OPRM1OPRL1GAA
SCHEMBL22997869 0.82 GABRA5 (0.42) EPHX1GAARGS12EPHX2NPC1
SCHEMBL20547948 0.81 MFN2 (0.65) EPHX1MFN2EPHX2TSHRSMN1; SMN2
SCHEMBL20547943 0.80 MFN2 (0.46) EPHX1MFN2GAAEPHX2
SCHEMBL21045472 0.77 MFN2 (0.68) EPHX1MFN2OPRM1OPRL1GAA
SCHEMBL22404824 0.75 MFN2 (0.43) EPHX1MFN2EPHX2
SCHEMBL17117397 0.73 EPHX1 (0.76) EPHX1OPRM1OPRL1EPHX2NPC1
SCHEMBL22404819 0.72 MFN2 (0.45) EPHX1MFN2GAAEPHX2
SCHEMBL21045564 0.72 MFN2 (0.45) EPHX1MFN2GAAEPHX2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760733-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2023-09-19 US claimed
US-20200281899-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2020-09-10 US claimed
US-11760733-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2023-09-19 US disclosed
US-11760733-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2023-09-19 US disclosed
US-11760733-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2023-09-19 US disclosed
US-11141390-B2 Mitofusin activators and methods of use thereof MITOCHONDRIA EMOTION, INC. (US) 2021-10-12 US disclosed
US-20210251927-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MITOCHONDRIA EMOTION, INC. (US) 2021-08-19 US disclosed
US-11026904-B2 Mitofusin activators and methods of use thereof MITOCHONDRIA EMOTION, INC. (US) 2021-06-08 US disclosed
US-20210046028-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MITOCHONDRIA EMOTION, INC. (US) 2021-02-18 US disclosed
US-10844023-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2020-11-24 US disclosed
US-10844023-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2020-11-24 US disclosed
US-20200345669-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MITOCHONDRIA EMOTION, INC. (US) 2020-11-05 US disclosed
US-20200281899-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2020-09-10 US disclosed
US-20200281899-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2020-09-10 US disclosed
WO-2020159576-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MITOCHONDRIA EMOTION, INC. (US) 2020-08-06 WO disclosed
US-20190169138-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2019-06-06 US disclosed
US-20190169138-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2019-06-06 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 (9 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-20190169138-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF MFN2, FIS1, RHOT2 EPHX1 4385/4885MFN2 1/4885OPRM1 4348/4885
US-11760733-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof MFN2, FIS1, RHOT2 EPHX1 4385/4885MFN2 1/4885OPRM1 4348/4885
US-11141390-B2 Mitofusin activators and methods of use thereof MFN2, FIS1, TFB2M EPHX1 4069/4885MFN2 1/4885OPRM1 4524/4885
US-11026904-B2 Mitofusin activators and methods of use thereof MFN2, FIS1, TFB2M EPHX1 4069/4885MFN2 1/4885OPRM1 4524/4885
US-20200281899-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF MFN2, FIS1, RHOT2 EPHX1 4385/4885MFN2 1/4885OPRM1 4348/4885
US-10844023-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof MFN2, FIS1, RHOT2 EPHX1 4385/4885MFN2 1/4885OPRM1 4348/4885
US-20200345669-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MFN2, FIS1, TFB2M EPHX1 4069/4885MFN2 1/4885OPRM1 4524/4885
US-20210251927-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MFN2, FIS1, TFB2M EPHX1 4069/4885MFN2 1/4885OPRM1 4524/4885
US-20210046028-A1 MITOFUSIN ACTIVATORS AND METHODS OF USE THEREOF MFN2, FIS1, TFB2M EPHX1 4069/4885MFN2 1/4885OPRM1 4524/4885

“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.