SCHEMBL24937145

SCHEMBL24937145

CCn1cc(C)c(OC)n1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
COMT P21964 1/20 0.35
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 2/20 0.33
RECQL P46063 2/20 0.33
MAP3K5 Q99683 2/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 2/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
POLB P06746 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL18376454 0.82 SMN1; SMN2 (0.36) SMN1; SMN2HTTL3MBTL1COMTALDH1A1
SCHEMBL18685172 0.79 RECQL (0.37) SMN1; SMN2HTTL3MBTL1COMTALDH1A1
SCHEMBL116289 0.78
SCHEMBL26754743 0.78 L3MBTL1 (0.41) SMN1; SMN2HTTL3MBTL1COMTALDH1A1
SCHEMBL24937059 0.78 SMN1; SMN2 (0.33) SMN1; SMN2HTTL3MBTL1COMTALDH1A1
SCHEMBL26829349 0.77 PIK3CG (0.33) SMN1; SMN2
SCHEMBL26828264 0.77 LRRK2 (0.37) MAP3K5GAA
SCHEMBL24828475 0.75 L3MBTL1 (0.36) SMN1; SMN2HTTL3MBTL1ALDH1A1NPC1
SCHEMBL24007205 0.75 L3MBTL1 (0.39) SMN1; SMN2HTTL3MBTL1ALDH1A1NPC1
SCHEMBL20642494 0.75 MAP3K5 (0.34) SMN1; SMN2HTTALDH1A1NPC1MAP3K5

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
WO-2023217879-A1 PYRROLIDIONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2023-11-16 WO disclosed
US-20230019732-A1 EGFR INHIBITORS BLUEPRINT MEDICINES CORPORATION 2023-01-19 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-20230019732-A1 EGFR INHIBITORS EGFR, ERBB2, ERBB3 SMN1; SMN2 4572/4885HTT 4716/4885L3MBTL1 3989/4885

“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.