SCHEMBL17571434

SCHEMBL17571434

CC[C@@H](CNc1ccc(Cl)cn1)NC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.43
▸ L3MBTL1 Q9Y468 4/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ PTK2 Q05397 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ NPC1 O15118 3/20 0.40
▸ GLA P06280 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ ADRA2C P18825 1/20 0.40
▸ FDPS P14324 1/20 0.39
▸ FDFT1 P37268 1/20 0.39
▸ RAB9A P51151 3/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL22678738 1.00 TSHR (0.43) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
Hydrochloric Acid SCHEMBL19435312 0.98 TSHR (0.42) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL17559611 0.81 TSHR (0.47) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL22678947 0.79 L3MBTL1 (0.45) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL17571376 0.79 L3MBTL1 (0.45) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL11294953 0.78 HCAR3 (0.57) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
Hydrochloric Acid SCHEMBL19435339 0.78 ADRA2A (0.46) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL19455191 0.78 L3MBTL1 (0.43) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL17571416 0.78 L3MBTL1 (0.43) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2
SCHEMBL12497548 0.76 PTK2 (0.56) TSHRL3MBTL1MAPK1PTK2SMN1; SMN2

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 6 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
EP-3189043-B1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LTD (GB) 2020-11-18 — — EP disclosed
US-20200270247-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LIMITED 2020-08-27 — — US disclosed
US-10611760-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2020-04-07 — — US disclosed
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR INDIVIOR INC. 2017-10-12 — — US disclosed
WO-2016034882-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LIMITED (GB) 2016-03-10 — — WO 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 (4 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 TSHR 166/4885L3MBTL1 4730/4885MAPK1 705/4885
US-20200270247-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR HCRTR1, HCRTR2, NPY1R TSHR 166/4885L3MBTL1 4730/4885MAPK1 705/4885
US-10611760-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R TSHR 166/4885L3MBTL1 4730/4885MAPK1 705/4885
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR HCRTR1, HCRTR2, NPY1R TSHR 166/4885L3MBTL1 4730/4885MAPK1 705/4885

“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.

Send feedback