SCHEMBL22375256

SCHEMBL22375256

CC[C@@H](CN(C)c1ncc(C(F)(F)F)cn1)N(C)C(=O)c1nc(N(C)C)cc2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ POLQ O75417 1/20 0.33
▸ CNR2 P34972 2/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ TACR1 P25103 2/20 0.32
▸ TSPO P30536 7/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ PMP22 Q01453 1/20 0.32
▸ NR1I3 Q14994 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ SCN9A Q15858 1/20 0.31
▸ SCN10A Q9Y5Y9 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL17559759 0.85 L3MBTL1 (0.34) L3MBTL1CNR2TACR1TSPOMEN1
SCHEMBL17559762 0.85 L3MBTL1 (0.34) L3MBTL1CNR2TACR1TSPOMEN1
SCHEMBL17559613 0.74 HCRTR1 (0.35) L3MBTL1CNR2TSPOALDH1A1KDM4E
SCHEMBL17559614 0.74 HCRTR1 (0.35) L3MBTL1CNR2TSPOALDH1A1KDM4E
SCHEMBL22375255 0.73 TSPO (0.31) TSPO
SCHEMBL19435368 0.72 HCRTR1 (0.49) —
SCHEMBL17571459 0.72 HCRTR1 (0.49) —
SCHEMBL17559765 0.70 CNR2 (0.44) CNR2
SCHEMBL17559764 0.70 CNR2 (0.44) CNR2
SCHEMBL19435372 0.70 CACNA1G (0.35) L3MBTL1POLQMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 — — US disclosed
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 — — US disclosed
US-20200270247-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LIMITED 2020-08-27 — — 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-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R L3MBTL1 4730/4885POLQ 4601/4885CNR2 79/4885
US-20200270247-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR HCRTR1, HCRTR2, NPY1R L3MBTL1 4730/4885POLQ 4601/4885CNR2 79/4885

“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.

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