SCHEMBL2118158

SCHEMBL2118158

COc1cc(S(=O)(=O)Nc2cc(-c3ccc(C#N)cc3)ccc2C)sc1C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACLY P53396 10/20 0.55
STAT3 P40763 1/20 0.43
BRD1 O95696 4/20 0.42
BRPF1 P55201 4/20 0.42
BRPF3 Q9ULD4 4/20 0.42
BRD9 Q9H8M2 3/20 0.42
BRD4 O60885 2/20 0.42
ALPL P05186 3/20 0.40
HSD11B1 P28845 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2117509 0.87 ACLY (0.42) ACLYSTAT3BRD1BRPF1BRPF3
SCHEMBL3467342 0.84 ACLY (0.45) ACLYSTAT3BRD1BRPF1BRPF3
SCHEMBL3467341 0.82 ACLY (0.43) ACLYALPLHSD11B1
SCHEMBL2119329 0.81 GHSR (0.45) ACLYSMN1; SMN2
SCHEMBL2117333 0.77 ALDH1A1 (0.54) ACLYHSD11B1SMN1; SMN2
SCHEMBL2119623 0.77 GHSR (0.45)
SCHEMBL2117577 0.76 MAPT (0.45) SMN1; SMN2
SCHEMBL3467338 0.75 CTSA (0.38) ACLYALPLSMN1; SMN2
SCHEMBL2119339 0.74 ACLY (0.48) ACLYSTAT3BRD1BRPF1BRPF3
SCHEMBL2118272 0.73 MEN1 (0.44) SMN1; SMN2

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-20120095012-A1 TOLUIDINE SULFONAMIDES AND THEIR USE ELARA PHARMACEUTICALS GMBH (DE) 2012-04-19 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-20120095012-A1 TOLUIDINE SULFONAMIDES AND THEIR USE HIF1A, HIF1AN, EGLN3 ACLY 1578/4885STAT3 99/4885BRD1 325/4885

“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.