SCHEMBL35536

SCHEMBL35536

Cc1ccc(S(=O)(=O)N(C)C)cc1C(=O)Oc1cccc(-c2c(C(C)C)cnc3c(Cl)cccc23)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
NR1H2 P55055 17/20 0.47
NR1H3 Q13133 17/20 0.47
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
RXFP1 Q9HBX9 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
SCHEMBL35086 0.91 NR1H2 (0.58) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL35158 0.89 NR1H2 (0.55) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL35209 0.88 MAPT (0.47) SMN1; SMN2NR1H2NR1H3MAPTLMNA
SCHEMBL35835 0.88 NR1H2 (0.50) SMN1; SMN2NPC1RAB9AKMT2ANR1H2
SCHEMBL35356 0.85 NR1H2 (0.51) MEN1RAB9AKMT2ANR1H2NR1H3
SCHEMBL45918 0.85 NR1H2 (0.50) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL35085 0.84 NR1H2 (0.58) SMN1; SMN2NR1H2NR1H3MAPTLMNA
SCHEMBL35310 0.81 NR1H2 (0.55) NR1H2NR1H3
SCHEMBL35160 0.80 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL35004 0.80 NR1H3 (0.52) NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 SMN1; SMN2 4218/4885MEN1 3801/4885NPC1 240/4885

“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.