SCHEMBL271335

SCHEMBL271335

CC(C)(C)c1ccc(S(=O)(=O)C2CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
ACHE P22303 1/20 0.51
HSD11B1 P28845 9/20 0.49
ALDH1A1 P00352 2/20 0.48
EPHX2 P34913 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
CCR6 P51684 1/20 0.44
ENPP3 O14638 2/20 0.44
ENPP1 P22413 2/20 0.44
ENPP2 Q13822 1/20 0.44

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
SCHEMBL18253221 0.91 ALDH1A1 (0.53) LMNAGAAACHEHSD11B1ALDH1A1
SCHEMBL270534 0.83 HSD11B1 (0.47) LMNAGAAACHEHSD11B1ALDH1A1
Hydrochloric Acid SCHEMBL4775646 0.81 HSD11B1 (0.46) LMNAGAAACHEHSD11B1ALDH1A1
SCHEMBL10797948 0.81 ALDH1A1 (0.45) LMNAGAAACHEHSD11B1ALDH1A1
SCHEMBL2421051 0.80 CCR6 (0.48) ALDH1A1EPHX2CCR6ENPP3ENPP1
Hydrochloric Acid SCHEMBL10794531 0.80 ALDH1A1 (0.44) LMNAGAAACHEHSD11B1ALDH1A1
SCHEMBL11507747 0.79 ALDH1A1 (0.56) LMNAGAAACHEALDH1A1
SCHEMBL7902426 0.79 ACHE (0.46) LMNAGAAACHEHSD11B1ALDH1A1
SCHEMBL27439230 0.79 HSD17B2 (0.38) LMNAGAAACHEHSD11B1ALDH1A1
SCHEMBL14227971 0.77 ALDH1A1 (0.53) LMNAGAAACHEALDH1A1

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-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110269721-A1 METHODS OF TREATING THALASSEMIA TARGEGEN, INC. (US) 2011-11-03 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 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-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 LMNA 4817/4885GAA 3793/4885ACHE 4826/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B LMNA 2236/4885GAA 49/4885ACHE 4749/4885

“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.