SCHEMBL617497

SCHEMBL617497

Cc1c(Cl)cccc1S(=O)(=O)Nc1ccc2cc[nH]c2c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.58
CYP19A1 P11511 1/20 0.58
HTR6 P50406 1/20 0.52
IDH1 O75874 1/20 0.52
HSD11B1 P28845 2/20 0.50
GSPT1 P15170 1/20 0.50
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SLC40A1 Q9NP59 1/20 0.46
EDNRB P24530 1/20 0.45
EDNRA P25101 1/20 0.45
PKM P14618 1/20 0.45
LMNA P02545 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
SCHEMBL615849 0.90 IDH1 (0.52) ESR1CYP19A1HTR6IDH1HSD11B1
SCHEMBL31701332 0.88 ESR1 (0.61) ESR1CYP19A1HTR6IDH1MEN1
SCHEMBL4884802 0.79 ESR1 (0.70) ESR1CYP19A1HTR6MEN1KMT2A
SCHEMBL616758 0.78 HSD11B1 (0.53) HSD11B1GSPT1DDB1CRBNMEN1
SCHEMBL616421 0.76 HSD11B1 (0.51) HSD11B1GSPT1DDB1CRBNMEN1
SCHEMBL5347991 0.76 MEN1 (0.78) HSD11B1MEN1KMT2ASLC40A1PKM
SCHEMBL7578851 0.76 HSD11B1 (0.58) IDH1HSD11B1MEN1KMT2ASLC40A1
SCHEMBL618067 0.76 BRD4 (0.56) HTR6HSD11B1GSPT1DDB1CRBN
SCHEMBL5343689 0.76 HSD11B1 (0.60) HSD11B1GSPT1DDB1CRBNMEN1
SCHEMBL5338606 0.75 HSD11B1 (0.55) HSD11B1GSPT1DDB1CRBNMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120041207-A1 Compound STERIX LIMITED (GB) 2012-02-16 US disclosed
US-20120041207-A1 Compound STERIX LIMITED (GB) 2012-02-16 US disclosed
US-20110009448-A1 Compound STERIX LIMITED 2011-01-13 US disclosed
US-20110009448-A1 Compound STERIX LIMITED 2011-01-13 US disclosed
US-7786152-B2 Compound STERIX LIMITED (GB) 2010-08-31 US disclosed
US-7786152-B2 Compound STERIX LIMITED (GB) 2010-08-31 US disclosed
US-7786152-B2 Compound STERIX LIMITED (GB) 2010-08-31 US disclosed
US-20080114042-A1 Inhibiting 11 beta-hydroxysteroid dehydrogenase (11 beta-HSD); use of sulfonamide-substituted N-heterocyclics including pyrroles, oxazoles, thiazoles, imidazoles and their fused analogs to treat diabetes, obesity, hypertension, arthritis, asthma, osteoporosis, breast cancer STERIX LIMITED (GB) 2008-05-15 US disclosed
US-20080114042-A1 Inhibiting 11 beta-hydroxysteroid dehydrogenase (11 beta-HSD); use of sulfonamide-substituted N-heterocyclics including pyrroles, oxazoles, thiazoles, imidazoles and their fused analogs to treat diabetes, obesity, hypertension, arthritis, asthma, osteoporosis, breast cancer STERIX LIMITED (GB) 2008-05-15 US disclosed
US-20080114042-A1 Inhibiting 11 beta-hydroxysteroid dehydrogenase (11 beta-HSD); use of sulfonamide-substituted N-heterocyclics including pyrroles, oxazoles, thiazoles, imidazoles and their fused analogs to treat diabetes, obesity, hypertension, arthritis, asthma, osteoporosis, breast cancer STERIX LIMITED (GB) 2008-05-15 US disclosed
US-7309715-B2 Compound STERIX LIMITED (GB) 2007-12-18 US disclosed
US-7309715-B2 Compound STERIX LIMITED (GB) 2007-12-18 US disclosed
US-7309715-B2 Compound STERIX LIMITED (GB) 2007-12-18 US disclosed
EP-1556040-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AND TYPE 2 Sterix Limited (GB) 2005-07-27 EP disclosed
US-20040143124-A1 Compound STERIX LIMITED (GB) 2004-07-22 US disclosed
WO-2004037251-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AND TYPE 2 STERIX LIMITED (GB) 2004-05-06 WO 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 (4 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-20080114042-A1 Inhibiting 11 beta-hydroxysteroid dehydrogenase (11 beta-HSD); use of sulfonamide-substituted N-heterocyclics including pyrroles, oxazoles, thiazoles, imidazoles and their fused analogs to treat diabetes, obesity, hypertension, arthritis, asthma, osteoporosis, breast cancer HSD11B1, HSD3B1, HSD11B2 ESR1 202/4885CYP19A1 29/4885HTR6 725/4885
US-20110009448-A1 Compound NR4A1, GPR6, PRMT6 ESR1 110/4885CYP19A1 124/4885HTR6 43/4885
US-20120041207-A1 Compound NR4A1, GPR6, PRMT6 ESR1 110/4885CYP19A1 124/4885HTR6 43/4885
US-20040143124-A1 Compound NR4A1, CBR1, NR2C2 ESR1 543/4885CYP19A1 155/4885HTR6 191/4885

“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.