SCHEMBL617064

SCHEMBL617064

Cc1nc2ccc(C)c(N)c2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.47
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
MAPT P10636 6/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TLR8 Q9NR97 1/20 0.41
TLR7 Q9NYK1 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 4/20 0.40
HTT P42858 2/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 2/20 0.39
HPGD P15428 3/20 0.38
TP53 P04637 2/20 0.38
PKM P14618 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
GLA P06280 1/20 0.37
CYP3A4 P08684 1/20 0.37
NT5E P21589 1/20 0.37

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
SCHEMBL21091183 0.84 MAPT (0.53) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL27370484 0.81 MAPT (0.43) SMN1; SMN2RAB9AMAPTMEN1KMT2A
SCHEMBL8688516 0.81 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL15001036 0.80 RAB9A (0.57) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL15800150 0.79 RAB9A (0.49) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL617907 0.78 KDM4E (0.46) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL15880311 0.78 SMN1; SMN2 (0.48) SMN1; SMN2RAB9ANPC1MAPTTLR8
SCHEMBL17561709 0.76 RAB9A (0.46) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL12109874 0.76 RAB9A (0.46) SMN1; SMN2RAB9ANPC1MAPTMEN1
SCHEMBL31344823 0.74 SMN1; SMN2 (0.46) SMN1; SMN2RAB9ANPC1MAPTMEN1

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 SMN1; SMN2 3762/4885RAB9A 4048/4885NPC1 2863/4885
US-20110009448-A1 Compound NR4A1, GPR6, PRMT6 SMN1; SMN2 3761/4885RAB9A 3099/4885NPC1 2357/4885
US-20120041207-A1 Compound NR4A1, GPR6, PRMT6 SMN1; SMN2 3761/4885RAB9A 3099/4885NPC1 2357/4885
US-20040143124-A1 Compound NR4A1, CBR1, NR2C2 SMN1; SMN2 3175/4885RAB9A 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.