SCHEMBL617202

SCHEMBL617202

COC(=O)c1c[nH]c2ccc(N)cc12

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 12/20 0.70
CREBBP Q92793 1/20 0.62
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.48
CYP2C19 P33261 1/20 0.48
MEN1 O00255 1/20 0.47
MITF O75030 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAP2K1 Q02750 1/20 0.47
PYGL P06737 1/20 0.45
F7 P08709 1/20 0.44
F3 P13726 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
SCHEMBL5631381 0.88 NR4A2 (0.70) NR4A2CREBBPGAAMAPTMAP2K1
SCHEMBL1007089 0.84 NR4A2 (0.50) NR4A2CREBBPHPGDCYP2C19MEN1
SCHEMBL6521138 0.84 GABRA1 (0.60) NR4A2GAAHPGDCYP2C19MEN1
SCHEMBL27365216 0.83 NR4A2 (0.72) NR4A2CREBBPGAAHPGDMEN1
SCHEMBL4240354 0.83 NR4A2 (1.00) NR4A2CREBBPMEN1MITFLMNA
SCHEMBL6488517 0.82 PBRM1 (0.59) NR4A2HPGDCYP2C19MEN1MITF
SCHEMBL1519903 0.82 F7 (0.64) NR4A2GAAHPGDCYP2C19MEN1
SCHEMBL4242189 0.81 NR4A2 (1.00) NR4A2CREBBPPYGLF7F3
SCHEMBL15300704 0.81 NR4A2 (0.70) NR4A2CREBBPMEN1MITFLMNA
SCHEMBL6635171 0.81 HPGD (0.48) NR4A2CREBBPHPGDCYP2C19LMNA

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 9 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
CN-1723022-A inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 and type 2 STERIX LTD (GB) 2006-01-18 CN 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 NR4A2 169/4885CREBBP 2269/4885GAA 4414/4885
US-20110009448-A1 Compound NR4A1, GPR6, PRMT6 NR4A2 21/4885CREBBP 1533/4885GAA 4874/4885
US-20120041207-A1 Compound NR4A1, GPR6, PRMT6 NR4A2 21/4885CREBBP 1533/4885GAA 4874/4885
US-20040143124-A1 Compound NR4A1, CBR1, NR2C2 NR4A2 26/4885CREBBP 2810/4885GAA 4650/4885

“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.