SCHEMBL24208917

SCHEMBL24208917

O=C(NCCNC1C2CC3CC(C2)CC1C3)c1cn(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 14/20 0.55
GABRB2 P47870 14/20 0.55
OPRL1 P41146 1/20 0.48
CNR2 P34972 2/20 0.43
CNR1 P21554 2/20 0.43

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
SCHEMBL24208712 0.84 CNR1 (0.60) CNR2CNR1
SCHEMBL24208915 0.82 CNR1 (0.58) CNR2CNR1
SCHEMBL24208703 0.82 CNR1 (0.58) CNR2CNR1
SCHEMBL30513027 0.82 CNR1 (0.59) CNR1
SCHEMBL24209030 0.82 CNR1 (0.59) CNR1
SCHEMBL25210484 0.82 CNR1 (0.59) CNR1
SCHEMBL27639293 0.81 GABRA2 (0.59) GABRA2GABRB2OPRL1
SCHEMBL24208891 0.81 CNR1 (0.47) CNR2CNR1
SCHEMBL24208783 0.79 CNR1 (0.72) CNR2CNR1
SCHEMBL25198056 0.79 CNR1 (0.72) CNR2CNR1

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 4 patents. 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 claimed
US-11655238-B2 MMPL3 inhibitors, compositions and uses thereof SHANGHAITECH UNIVERSITY (CN) 2023-05-23 US disclosed
US-11655238-B2 MMPL3 inhibitors, compositions and uses thereof SHANGHAITECH UNIVERSITY (CN) 2023-05-23 US disclosed
US-20220017492-A1 MMPL3 INHIBITORS, COMPOSITIONS AND USES THEREOF SHANGHAITECH UNIVERSITY (CN) 2022-01-20 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 (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-11655238-B2 MMPL3 inhibitors, compositions and uses thereof TIMP3, AFG3L2, MMP3 GABRA2 4541/4885GABRB2 4587/4885OPRL1 3496/4885
US-20220017492-A1 MMPL3 INHIBITORS, COMPOSITIONS AND USES THEREOF TIMP3, AFG3L2, MMP3 GABRA2 4541/4885GABRB2 4587/4885OPRL1 3496/4885

“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.