SCHEMBL25517568

SCHEMBL25517568

CCC1(NCCS(=O)(=O)NCc2nn(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)c2C)CC2CC(C)(C)CC(C)(C2)C1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.47
KCNH2 Q12809 2/20 0.47
CNR2 P34972 9/20 0.42
CNR1 P21554 7/20 0.42

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
SCHEMBL24208876 0.88 OPRL1 (0.51) OPRL1KCNH2CNR2CNR1
SCHEMBL25265924 0.88 OPRL1 (0.51) OPRL1KCNH2CNR2CNR1
SCHEMBL25199132 0.88 OPRL1 (0.51) OPRL1KCNH2CNR2CNR1
SCHEMBL24208879 0.78 OPRL1 (0.47) OPRL1KCNH2CNR2CNR1
SCHEMBL25509775 0.77 OPRL1 (0.48) OPRL1KCNH2CNR2CNR1
SCHEMBL1379074 0.76 OPRL1 (0.62) OPRL1KCNH2CNR2CNR1
SCHEMBL25212508 0.73 OPRL1 (0.53) OPRL1KCNH2CNR2CNR1
SCHEMBL25212509 0.73 OPRL1 (0.53) OPRL1KCNH2CNR2CNR1
SCHEMBL24208916 0.73 OPRL1 (0.53) OPRL1KCNH2CNR2CNR1
SCHEMBL1378458 0.71 OPRL1 (0.56) OPRL1KCNH2CNR2CNR1

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-11655238-B2 MMPL3 inhibitors, compositions and uses thereof SHANGHAITECH UNIVERSITY (CN) 2023-05-23 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-11655238-B2 MMPL3 inhibitors, compositions and uses thereof TIMP3, AFG3L2, MMP3 OPRL1 3496/4885KCNH2 4695/4885CNR2 4645/4885

“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.