SCHEMBL617907

SCHEMBL617907

COc1ccc2nc(C)sc2c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
RAB9A P51151 5/20 0.46
NPC1 O15118 3/20 0.46
MAPT P10636 3/20 0.46
ATM Q13315 2/20 0.46
MAPK1 P28482 2/20 0.46
GAA P10253 1/20 0.46
THRB P10828 1/20 0.46
BLM P54132 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.42
PPARG P37231 1/20 0.42
PTK2B Q14289 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NR2E3 Q9Y5X4 1/20 0.42

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
SCHEMBL19435575 0.79 KDM4E (0.48) KDM4ERAB9ANPC1MAPTATM
SCHEMBL617064 0.78 SMN1; SMN2 (0.47) KDM4ERAB9ANPC1MAPTGAA
SCHEMBL8040045 0.77 NQO2 (0.47) KDM4ERAB9ANPC1MAPTATM
SCHEMBL11582451 0.76 CA2 (0.54) KDM4ERAB9ANPC1MAPTATM
SCHEMBL8326622 0.76 KDM4E (0.45) KDM4ERAB9ANPC1MAPTATM
SCHEMBL8688516 0.75 SMN1; SMN2 (0.44) KDM4ERAB9ANPC1MAPTGAA
SCHEMBL15001036 0.74 RAB9A (0.57) KDM4ERAB9ANPC1MAPTATM
SCHEMBL2404277 0.74 MEN1 (0.51) KDM4ERAB9ANPC1MAPTGAA
SCHEMBL11690597 0.72 CYP3A4 (0.46) KDM4ERAB9ANPC1MAPTATM
SCHEMBL15880311 0.72 SMN1; SMN2 (0.48) KDM4ERAB9ANPC1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120041207-A1 Compound STERIX LIMITED (GB) 2012-02-16 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-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
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 KDM4E 2033/4885RAB9A 4048/4885NPC1 2863/4885
US-20110009448-A1 Compound NR4A1, GPR6, PRMT6 KDM4E 565/4885RAB9A 3099/4885NPC1 2357/4885
US-20120041207-A1 Compound NR4A1, GPR6, PRMT6 KDM4E 565/4885RAB9A 3099/4885NPC1 2357/4885
US-20040143124-A1 Compound NR4A1, CBR1, NR2C2 KDM4E 893/4885RAB9A 1545/4885NPC1 1368/4885

“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.