SCHEMBL25487553

SCHEMBL25487553

Cc1cccc(CN(C)[C@H]2CCN(C(=O)Cl)[C@@H](C)C2)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 3/20 0.48
HRH3 Q9Y5N1 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.39
HSP90AA1 P07900 1/20 0.38
TACR1 P25103 1/20 0.38
SMYD3 Q9H7B4 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
OPRM1 P35372 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
UBE2M P61081 1/20 0.37
DCUN1D1 Q96GG9 1/20 0.37

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
SCHEMBL29069991 0.86 AGTR2 (0.46) AGTR2MEN1KMT2ATACR1ALDH1A1
SCHEMBL29069990 0.86 AGTR2 (0.46) AGTR2MEN1KMT2ATACR1ALDH1A1
SCHEMBL20567316 0.86 AGTR2 (0.46) AGTR2MEN1KMT2ATACR1ALDH1A1
SCHEMBL25487544 0.85 JAK2 (0.49) AGTR2MEN1KMT2ATACR1
SCHEMBL25830163 0.81 MGLL (0.43) AGTR2HSP90AA1SMYD3
SCHEMBL25830251 0.81 MGLL (0.43) AGTR2HSP90AA1SMYD3
SCHEMBL25830258 0.81 MGLL (0.43) AGTR2HSP90AA1SMYD3
SCHEMBL25830260 0.81 MGLL (0.43) AGTR2HSP90AA1SMYD3
SCHEMBL25488083 0.80 MGLL (0.47) AGTR2SMYD3
SCHEMBL25488085 0.80 MGLL (0.47) AGTR2SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219897-A1 PYRAZOLE MAGL INHIBITORS H. LUNDBECK A/S (DK) 2023-07-13 US disclosed
US-11655217-B2 Pyrazole MAGL inhibitors H. LUNDBECK A/S (DK) 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 (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-20230219897-A1 PYRAZOLE MAGL INHIBITORS MGLL, PNLIP, LPL AGTR2 3478/4885HRH3 3194/4885MEN1 3845/4885
US-11655217-B2 Pyrazole MAGL inhibitors MGLL, PNLIP, LPL AGTR2 3746/4885HRH3 3240/4885MEN1 4052/4885

“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.