SCHEMBL617843

SCHEMBL617843

CCCc1ccc(S(=O)(=O)Nc2ccc3nc(C)oc3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.55
ATM Q13315 2/20 0.55
TP53 P04637 6/20 0.52
LMNA P02545 5/20 0.52
FFAR4 Q5NUL3 2/20 0.50
POLB P06746 4/20 0.49
KIT P10721 1/20 0.48
NR1I2 O75469 1/20 0.48
PTPN2 P17706 3/20 0.48
PTPN1 P18031 3/20 0.48
PTPN5 P54829 3/20 0.48
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
XBP1 P17861 1/20 0.46
FFAR1 O14842 1/20 0.45
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
HTR6 P50406 1/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL616006 0.91 PTPN2 (0.59) MAPTATMFFAR4KITNR1I2
SCHEMBL5335098 0.81 CDC7 (0.68) MAPTATMLMNAFFAR4POLB
SCHEMBL3037113 0.79 MAPT (0.56) MAPTTP53LMNAPOLBPTPN2
SCHEMBL5335572 0.79 MAPT (0.57) MAPTATMLMNAFFAR4POLB
SCHEMBL618559 0.77 LMNA (0.74) MAPTATMLMNAFFAR4POLB
SCHEMBL5337489 0.77 ATM (0.55) MAPTATMLMNAFFAR4POLB
SCHEMBL5389593 0.77 NR1I2 (0.58) MAPTATMLMNAFFAR4POLB
SCHEMBL8247663 0.77 TAS1R3 (0.47) MAPTPOLBKDM4EALDH1A1GAA
SCHEMBL5340962 0.75 ALDH1A1 (0.72) MAPTATMLMNAFFAR4POLB
SCHEMBL5338915 0.75 MAPT (0.53) MAPTATMTP53FFAR4POLB

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-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-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
US-20040143124-A1 Compound STERIX LIMITED (GB) 2004-07-22 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 (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 MAPT 4759/4885ATM 3285/4885TP53 2714/4885
US-20110009448-A1 Compound NR4A1, GPR6, PRMT6 MAPT 4794/4885ATM 3415/4885TP53 3850/4885
US-20120041207-A1 Compound NR4A1, GPR6, PRMT6 MAPT 4794/4885ATM 3415/4885TP53 3850/4885
US-20040143124-A1 Compound NR4A1, CBR1, NR2C2 MAPT 4691/4885ATM 3236/4885TP53 4119/4885

“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.