SCHEMBL25880716

SCHEMBL25880716

O=S(=O)(Oc1cc2ccn(C3CC4CCC(C3)N4Cc3ccccc3)c2nn1)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 12/20 0.39
OPRK1 P41145 9/20 0.38
UBE2M P61081 1/20 0.37
DCUN1D1 Q96GG9 1/20 0.37
OPRM1 P35372 5/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
SLC6A2 P23975 1/20 0.36
DRD3 P35462 1/20 0.36
SCN8A Q9UQD0 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM3 P20309 1/20 0.35
OPRD1 P41143 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL25880723 0.78 KCNH2 (0.46) KCNH2OPRK1OPRM1CHRM2CHRM3
SCHEMBL30833233 0.68 KCNH2 (0.56) KCNH2OPRK1OPRM1OPRD1
SCHEMBL22165423 0.66 MEN1 (0.39) KCNH2OPRK1OPRM1DRD2DRD4
SCHEMBL521041 0.64 DRD2 (0.36) KCNH2OPRK1DRD2DRD4SLC6A2
SCHEMBL30833216 0.63 KCNH2 (0.58) KCNH2OPRK1OPRM1OPRD1
SCHEMBL14636209 0.62 CHRM2 (0.46) KCNH2OPRK1UBE2MDCUN1D1OPRM1
SCHEMBL5264387 0.61 KCNH2 (0.55) KCNH2OPRK1OPRM1DRD2DRD4
SCHEMBL20483452 0.60 CHRM2 (0.64) KCNH2OPRK1OPRM1DRD2DRD4
SCHEMBL4591949 0.60 PKM (0.42)
SCHEMBL14637727 0.60 CHRM2 (0.42) KCNH2OPRK1UBE2MDCUN1D1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227474-A1 COMPOSITIONS AND METHODS FOR CORRECTION OF ABERRANT SPLICING SKYHAWK THERAPEUTICS, INC. (US) 2023-07-20 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 (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-20230227474-A1 COMPOSITIONS AND METHODS FOR CORRECTION OF ABERRANT SPLICING RBM17, SF3B1, SF3B5 KCNH2 4599/4885OPRK1 3864/4885UBE2M 2418/4885

“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.