SCHEMBL35209

SCHEMBL35209

CC(C)c1cnc2c(Cl)cccc2c1-c1cccc(OC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NR1H2 P55055 15/20 0.47
NR1H3 Q13133 15/20 0.47
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.40
F2 P00734 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RECQL P46063 1/20 0.38

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
SCHEMBL35835 0.92 NR1H2 (0.50) MAPTSMN1; SMN2NR1H2NR1H3LMNA
SCHEMBL35310 0.90 NR1H2 (0.55) NR1H2NR1H3
SCHEMBL35536 0.88 SMN1; SMN2 (0.49) MAPTSMN1; SMN2NR1H2NR1H3ALDH1A1
SCHEMBL38526 0.84 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL35630 0.83 NR1H2 (0.51) NR1H2NR1H3
SCHEMBL35301 0.82 NR1H2 (0.52) NR1H2NR1H3
SCHEMBL35085 0.82 NR1H2 (0.58) MAPTSMN1; SMN2NR1H2NR1H3LMNA
SCHEMBL45917 0.81 NR1H2 (0.55) NR1H2NR1H3
SCHEMBL35224 0.81 NR1H2 (0.51) NR1H2NR1H3
SCHEMBL35086 0.80 NR1H2 (0.58) SMN1; SMN2NR1H2NR1H3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590948-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS Wyeth LLC (US) 2013-05-15 EP claimed
WO-2012004748-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS WYETH LLC (US) 2012-01-12 WO claimed
US-20120010205-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS WYETH LLC (US) 2012-01-12 US claimed
EP-2590948-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS Wyeth LLC (US) 2013-05-15 EP disclosed
WO-2012004748-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS WYETH LLC (US) 2012-01-12 WO disclosed
US-20120010205-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS WYETH LLC (US) 2012-01-12 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-20120010205-A1 NOVEL QUINOLINE ESTERS USEFUL FOR TREATING SKIN DISORDERS NR1H2, NR1H3, NR1H4 MAPT 4413/4885SMN1; SMN2 4218/4885NR1H2 1/4885

“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.