SCHEMBL1605549

SCHEMBL1605549

Cc1ccc(OCCN2CCOCC2)cc1NC1=NC(=O)C(C(C)C)S1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPK14 Q16539 5/20 0.48
NPC1 O15118 2/20 0.47
AURKA O14965 1/20 0.45
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LCK P06239 1/20 0.42
CHUK O15111 3/20 0.41
INSR P06213 3/20 0.41
MAPK8 P45983 3/20 0.41
CAMKK2 Q96RR4 3/20 0.41
ALOX5 P09917 1/20 0.40
CCR4 P51679 1/20 0.40

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
SCHEMBL10285223 0.93 MEN1 (0.52) MEN1KMT2AMAPK14NPC1AURKA
SCHEMBL1605640 0.77 PRKDC (0.39)
SCHEMBL13121672 0.74 NPC1 (0.51) MEN1KMT2AMAPK14NPC1AURKA
SCHEMBL1384951 0.72 SMN1; SMN2 (0.43) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL259795 0.70 NPC1 (0.77) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL12040810 0.70 MEN1 (0.79) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL30344157 0.69 NPC1 (0.59) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL1911879 0.68 NPC1 (0.69) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL30344808 0.68 KDM4E (0.62) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL12049108 0.68 MEN1 (0.67) MEN1KMT2ANPC1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541592-B2 Inhibitors of 11-beta-hydroxysteroid dehydrogenase type 1 AMGEN INC. (US) 2013-09-24 US disclosed
US-20120010256-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB 2012-01-12 US disclosed
US-20110082107-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC. 2011-04-07 US disclosed
EP-1753736-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC (US) 2008-12-17 EP disclosed
US-20070197598-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AMGEN INC. 2007-08-23 US disclosed
US-7253196-B2 Inhibitors of 11-β-hydroxy steroid dehydrogenase type 1 AMGEN, INC. (US) 2007-08-07 US disclosed
US-20060142357-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AMGEN INC. 2006-06-29 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-20110082107-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD3B1, HSD17B1 MEN1 806/4885KMT2A 3049/4885MAPK14 3769/4885
US-20070197598-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD11B2 MEN1 877/4885KMT2A 3245/4885MAPK14 2772/4885
US-20060142357-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD3B1, HSD17B1 MEN1 806/4885KMT2A 3049/4885MAPK14 3769/4885
US-20120010256-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD3B1, HSD17B1 MEN1 806/4885KMT2A 3049/4885MAPK14 3769/4885

“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.