SCHEMBL10220735

SCHEMBL10220735

CC(C)C(C)(C)S(=O)(=O)N1CCC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
TSHR P16473 2/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
POLB P06746 2/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PKM P14618 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL1104444 0.75 GAA (0.42) GAATSHRKMT2ACA1CA2
SCHEMBL16687718 0.75 LMNA (0.35) GAATSHRKMT2ACA1CA2
SCHEMBL13062683 0.74
SCHEMBL16317483 0.74 LMNA (0.38) GAATSHRKMT2ACA1CA2
SCHEMBL10171235 0.72 DPP4 (0.30)
SCHEMBL15925425 0.72 CA1 (0.38) GAATSHRKMT2ACA1CA2
SCHEMBL10171119 0.71 GAA (0.39) GAATSHRKMT2ACA1CA2
SCHEMBL12251533 0.70 CA1 (0.43) GAATSHRKMT2ACA1CA2
SCHEMBL1104450 0.69 CA1 (0.48) GAATSHRKMT2ACA1CA2
SCHEMBL12256387 0.67 CA1 (0.40) GAATSHRKMT2ACA1CA2

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-20120010184-A1 Therapeutic Uses of Compounds Which Selectively Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-12 US disclosed
US-20100331304-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-30 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-20100331304-A1 Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 GAA 4409/4885TSHR 876/4885KMT2A 3644/4885
US-20120010184-A1 Therapeutic Uses of Compounds Which Selectively Modulate The CB2 Receptor CNR2, CNR1, OPRL1 GAA 4011/4885TSHR 907/4885KMT2A 3917/4885

“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.