SCHEMBL26601643

SCHEMBL26601643

Cc1cc(C(C)(C)C)ccc1-c1cc(OCc2ccccc2)c(Br)c(C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
STAT3 P40763 1/20 0.41
HTT P42858 1/20 0.41
MAPK1 P28482 3/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
CASP3 P42574 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
ATP4A P20648 3/20 0.37
ATP4B P51164 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 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
SCHEMBL26601938 0.86 MRGPRX4 (0.43) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL26601634 0.86 MRGPRX4 (0.43) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL26706194 0.84 MRGPRX4 (0.44) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL31747877 0.84 MRGPRX4 (0.44) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL26601774 0.84 MRGPRX4 (0.43) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL26601676 0.84 MRGPRX4 (0.51) MRGPRX4SMN1; SMN2STAT3HTTL3MBTL1
SCHEMBL26601687 0.83 MRGPRX4 (0.40) MRGPRX4SMN1; SMN2STAT3HTTATP4A
SCHEMBL26601626 0.83 MRGPRX4 (0.43) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL31747872 0.83 MAPK14 (0.41) MRGPRX4SMN1; SMN2STAT3HTTMAPK1
SCHEMBL26707868 0.83 MAPK14 (0.41) MRGPRX4SMN1; SMN2STAT3HTTMAPK1

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-20250388541-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-12-25 US disclosed
EP-4511117-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN Vertex Pharmaceuticals Incorporated (US) 2025-02-26 EP disclosed
WO-2023205465-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-26 WO disclosed
WO-2023205465-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-26 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 (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-20250388541-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN SCN1B, CLIC1, HCN1 MRGPRX4 999/4885SMN1; SMN2 760/4885STAT3 3474/4885

“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.