SCHEMBL20548158

SCHEMBL20548158

CC(Cl)C(=O)NC1CCCCC1C

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 5/20 0.54
TAS1R1 Q7RTX1 4/20 0.54
EPHX1 P07099 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
ATM Q13315 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
TAS1R2 Q8TE23 3/20 0.46
USP2 O75604 1/20 0.45

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
SCHEMBL12858462 0.86 JAK2 (0.53) TAS1R3TAS1R1SMN1; SMN2ATMTDP1
SCHEMBL1588987 0.82 EPHX1 (0.56) TAS1R3TAS1R1EPHX1SMN1; SMN2TDP1
SCHEMBL23479840 0.81 TAS1R3 (0.53) TAS1R3TAS1R1EPHX1SMN1; SMN2TDP1
SCHEMBL23479839 0.81 TAS1R3 (0.53) TAS1R3TAS1R1EPHX1SMN1; SMN2TDP1
SCHEMBL16648601 0.76 EPHX1 (0.81) TAS1R3TAS1R1EPHX1SMN1; SMN2TAS1R2
SCHEMBL25689275 0.75 EPHX1 (0.61) TAS1R3TAS1R1EPHX1SMN1; SMN2TAS1R2
SCHEMBL11067027 0.75 ATM (0.73) EPHX1SMN1; SMN2ATM
SCHEMBL23772197 0.74 EPHX1 (0.60) TAS1R3TAS1R1EPHX1SMN1; SMN2TAS1R2
SCHEMBL23573438 0.74 EPHX1 (0.60) TAS1R3TAS1R1EPHX1SMN1; SMN2TAS1R2
SCHEMBL23573200 0.74 EPHX1 (0.60) TAS1R3TAS1R1EPHX1SMN1; SMN2TAS1R2

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 5 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 disclosed
US-10844023-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof WASHINGTON UNIVERSITY (US) 2020-11-24 US disclosed
US-20200281899-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2020-09-10 US disclosed
US-20190169138-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2019-06-06 US disclosed
WO-2018200323-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY (US) 2018-11-01 WO 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 (4 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 TAS1R3 4410/4885TAS1R1 4241/4885EPHX1 4385/4885
US-11760733-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof MFN2, FIS1, RHOT2 TAS1R3 4410/4885TAS1R1 4241/4885EPHX1 4385/4885
US-20200281899-A1 SMALL MOLECULE REGULATORS OF MITOCHONDRIAL FUSION AND METHODS OF USE THEREOF MFN2, FIS1, RHOT2 TAS1R3 4410/4885TAS1R1 4241/4885EPHX1 4385/4885
US-10844023-B2 Small molecule regulators of mitochondrial fusion and methods of use thereof MFN2, FIS1, RHOT2 TAS1R3 4410/4885TAS1R1 4241/4885EPHX1 4385/4885

“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.