SCHEMBL3275328

SCHEMBL3275328

CCCNc1ccc(C(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.50
CA1 P00915 4/20 0.49
CA2 P00918 4/20 0.49
MAPT P10636 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TRPV1 Q8NER1 2/20 0.43
NPC1 O15118 1/20 0.43
XBP1 P17861 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TSHR P16473 1/20 0.41
PDK1 Q15118 1/20 0.41

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
SCHEMBL11347496 0.88 HDAC3 (0.51) HRH3CA1CA2MAPTMEN1
SCHEMBL22677533 0.84 HDAC3 (0.54) HRH3CA1CA2MAPTMEN1
SCHEMBL5281377 0.84 HDAC3 (0.54) HRH3CA1CA2MAPTMEN1
SCHEMBL1924747 0.83 MAPT (0.57) CA1CA2MAPTMEN1KMT2A
SCHEMBL4268165 0.83 MEN1 (0.59) CA1CA2MAPTMEN1KMT2A
SCHEMBL8025764 0.82 CA1 (0.46) HRH3CA1CA2MAPTMEN1
SCHEMBL25557821 0.81 HDAC3 (0.48) HRH3CA1CA2MAPTMEN1
SCHEMBL13167595 0.81 HRH3 (0.49) HRH3CA1CA2MAPTMEN1
SCHEMBL12781694 0.81 HRH3 (0.49) HRH3CA1CA2MAPTMEN1
SCHEMBL1950603 0.81 HRH3 (0.49) HRH3CA1CA2MAPTMEN1

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-11840527-B2 Non-fused thiophene derivatives and their uses ENYO PHARMA (FR) 2023-12-12 US disclosed
EP-2197981-A2 GREEN LUMINESCENT MATERIALS E. I. Du Pont de Nemours and Company (US) 2010-06-23 EP disclosed
WO-2008150828-A2 GREEN LUMINESCENT MATERIALS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-12-11 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-11840527-B2 Non-fused thiophene derivatives and their uses FTH1, SLC40A1, FECH HRH3 4237/4885CA1 4832/4885CA2 3530/4885

“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.