SCHEMBL16252995

SCHEMBL16252995

CC(C)(C)C1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.76
GAA P10253 2/20 0.56
LMNA P02545 1/20 0.55
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
USP2 O75604 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 1/20 0.50
ATM Q13315 1/20 0.50
HTT P42858 2/20 0.49
TSHR P16473 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
PSEN1 P49768 2/20 0.48
PSEN2 P49810 2/20 0.48
APH1B Q8WW43 2/20 0.48
NCSTN Q92542 2/20 0.48
APH1A Q96BI3 2/20 0.48
PSENEN Q9NZ42 2/20 0.48
ACHE P22303 1/20 0.48

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
SCHEMBL10224222 0.86 POLB (0.56) POLBGAALMNAMEN1KMT2A
SCHEMBL12201514 0.82 LMNA (0.69) POLBLMNAMEN1KMT2AL3MBTL1
SCHEMBL5253065 0.81 MEN1 (0.68) POLBLMNAMEN1KMT2AUSP2
SCHEMBL5252269 0.78 POLB (0.64) POLBGAALMNAMEN1KMT2A
SCHEMBL68943 0.78 POLB (0.64) POLBGAALMNAMEN1KMT2A
SCHEMBL68944 0.78 POLB (0.64) POLBGAALMNAMEN1KMT2A
SCHEMBL26363925 0.77 ALDH1A1 (0.51) POLBGAALMNAMEN1KMT2A
SCHEMBL10224164 0.76 GAA (0.55) POLBGAALMNAL3MBTL1ALDH1A1
SCHEMBL29333973 0.76 ALDH1A1 (0.62) POLBLMNAMEN1KMT2AALDH1A1
SCHEMBL10224175 0.76 GAA (0.45) POLBGAALMNAKMT2AHSD11B1

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
US-8889670-B2 Heterocyclic compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-11-18 US disclosed
US-20110312944-A1 Heterocyclic Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 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-20110312944-A1 Heterocyclic Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 POLB 4666/4885GAA 4497/4885LMNA 4475/4885

“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.