SCHEMBL30455542

SCHEMBL30455542

CC(C)(C)OC(=O)N1C[C@H]2CC(Nc3cc(C(F)(F)F)c(Cl)nn3)C[C@H]2C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.41
GPR119 Q8TDV5 4/20 0.41
JAK1 P23458 2/20 0.39
USP30 Q70CQ3 1/20 0.38
IL1B P01584 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
EHMT2 Q96KQ7 1/20 0.36
PTGES O14684 1/20 0.36
POLB P06746 1/20 0.35
GRIN2B Q13224 1/20 0.35
JAK2 O60674 1/20 0.35
EPHX2 P34913 1/20 0.35
SSTR4 P31391 1/20 0.35
SYK P43405 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
SCHEMBL23956997 1.00 NR1H2 (0.41) NR1H2GPR119JAK1USP30IL1B
SCHEMBL25625907 1.00 NR1H2 (0.41) NR1H2GPR119JAK1USP30IL1B
SCHEMBL30367657 0.94 NR1H2 (0.41) NR1H2GPR119JAK1USP30HDAC1
SCHEMBL30367419 0.92 NR1H2 (0.43) NR1H2GPR119JAK1USP30HDAC1
SCHEMBL29919449 0.86 NR1H2 (0.46) NR1H2GPR119JAK1USP30HDAC1
SCHEMBL24575390 0.86 NR1H2 (0.46) NR1H2GPR119JAK1USP30HDAC1
SCHEMBL23933511 0.85 GRIN2B (0.39) JAK1IL1BGRIN2BJAK2
SCHEMBL23933508 0.85 GRIN2B (0.39) JAK1IL1BGRIN2BJAK2
SCHEMBL23933514 0.85 GRIN2B (0.39) JAK1IL1BGRIN2BJAK2
SCHEMBL24575034 0.85 NR1H2 (0.40) NR1H2GPR119JAK1USP30HDAC1

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-20230183219-A1 CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2023-06-15 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-20230183219-A1 CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM3, CHRM2, CHRM4 NR1H2 498/4885GPR119 119/4885JAK1 3042/4885

“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.