SCHEMBL20547110

SCHEMBL20547110

CC1(C)CC(=O)CC(C)(C)N1C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.48
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPK1 P28482 2/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
CTRB1 P17538 1/20 0.45
P2RX4 Q99571 2/20 0.44
CYP2C19 P33261 1/20 0.44
P2RX1 P51575 1/20 0.43
P2RX3 P56373 1/20 0.43
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43

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
SCHEMBL11810226 0.84 HTR2C (0.49) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11791763 0.82 HTR2C (0.48) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL20052742 0.81 HTR2C (0.53) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL23123961 0.81 NPC1 (0.47) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL10797345 0.78 ALDH1A1 (0.53) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL20600085 0.77 KMT2A (0.39) ALDH1A1SMN1; SMN2MAPK1GAAKMT2A
SCHEMBL9573747 0.77 HTR2C (0.49) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL13818212 0.77 ALDH1A1 (0.51) ALDH1A1MAPK1KMT2AL3MBTL1SLC6A2
SCHEMBL15636331 0.77 MEN1 (0.54) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11707471 0.76 ALDH1A1 (0.44) HTR2CALDH1A1NPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3340988-B1 ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES AFASCI INC (US) 2025-04-09 EP disclosed
US-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses AFASCI, INC. (US) 2020-02-18 US disclosed
US-20180312471-A1 Ion Channel Inhibitory Compounds, Pharmaceutical Formulations, and Uses AFASCI, INC. (US) 2018-11-01 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-10562857-B2 Ion channel inhibitory compounds, pharmaceutical formulations, and uses CACNA1I, CACNA1G, CACNA1H HTR2C 347/4885ALDH1A1 2756/4885NPC1 1069/4885
US-20180312471-A1 Ion Channel Inhibitory Compounds, Pharmaceutical Formulations, and Uses CACNA1I, CACNA1G, CACNA1H HTR2C 347/4885ALDH1A1 2756/4885NPC1 1069/4885

“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.