SCHEMBL1955697

SCHEMBL1955697

Cc1ccc(S(=O)(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
POLB P06746 1/20 0.62
PKM P14618 1/20 0.62
HTT P42858 1/20 0.62
TGM2 P21980 9/20 0.60
F13A1 P00488 6/20 0.60
TGM1 P22735 3/20 0.60
KMT2A Q03164 5/20 0.55
MEN1 O00255 2/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL18410584 0.95 TGM2 (0.65) ALDH1A1POLBPKMHTTTGM2
SCHEMBL12550181 0.89 LMNA (0.60) POLBTGM2F13A1TGM1LMNA
SCHEMBL1917656 0.89 TGM2 (0.64) POLBPKMTGM2F13A1TGM1
SCHEMBL14490210 0.89 TGM2 (0.59) ALDH1A1PKMTGM2F13A1TGM1
SCHEMBL1955143 0.88 TGM2 (0.58) ALDH1A1PKMTGM2F13A1TGM1
SCHEMBL24693750 0.86 TGM2 (0.56) POLBPKMTGM2F13A1TGM1
SCHEMBL6977995 0.86 TGM2 (0.58) ALDH1A1POLBTGM2F13A1TGM1
SCHEMBL14490221 0.84 ABL1 (0.55) ALDH1A1PKMHTTTGM2F13A1
SCHEMBL23788561 0.83 ALDH1A1 (0.62) ALDH1A1TGM2F13A1TGM1LMNA
SCHEMBL5253160 0.83 POLB (0.70) POLBTGM2F13A1TGM1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110129542-A1 SUBSTITUTED AZEPINE- AND DIAZEPINE-SULFONAMIDES USEFUL TO INHIBIT 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE-1 SCHERING CORPORATION 2011-06-02 US claimed
EP-2190820-A2 SUBSTITUTED AZEPINE- AND DIAZEPINE-SULFONAMIDES USEFUL TO INHIBIT 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE-1 SCHERING CORPORATION (US) 2010-06-02 EP claimed
WO-2009023664-A2 SUBSTITUTED AZEPINE- AND DIAZEPINE-SULFONAMIDES USEFUL TO INHIBIT 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE-1 SCHERING CORPORATION (US) 2009-02-19 WO claimed
US-20110129542-A1 SUBSTITUTED AZEPINE- AND DIAZEPINE-SULFONAMIDES USEFUL TO INHIBIT 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE-1 SCHERING CORPORATION 2011-06-02 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-20110129542-A1 SUBSTITUTED AZEPINE- AND DIAZEPINE-SULFONAMIDES USEFUL TO INHIBIT 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE-1 HSD11B1, HSD17B1, HSD3B1 ALDH1A1 45/4885POLB 2900/4885PKM 3613/4885

“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.