SCHEMBL770444

SCHEMBL770444

COc1ccc(CNC(=O)CCCC(=O)N2CCCC3CCCCC32)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
HRH3 Q9Y5N1 1/20 0.51
KMT2A Q03164 2/20 0.48
DPP4 P27487 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
PKM P14618 1/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
CNR1 P21554 2/20 0.47
GAA P10253 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
CNR2 P34972 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL770630 0.90 ALDH1A1 (0.51) ALDH1A1DPP4NPC1CNR1
SCHEMBL17690709 0.87 TRPV1 (0.46) DPP4SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL769950 0.87 HRH3 (0.53) ALDH1A1HRH3LMNA
SCHEMBL769899 0.86 DRD2 (0.57) ALDH1A1HRH3KMT2ANPC1RAB9A
SCHEMBL770291 0.86 GAA (0.56) ALDH1A1HRH3KMT2ADPP4SMN1; SMN2
SCHEMBL770456 0.84 MEN1 (0.55) ALDH1A1HRH3KMT2ADPP4SMN1; SMN2
SCHEMBL771171 0.83 HDAC3 (0.51) HRH3DPP4LMNA
SCHEMBL770752 0.81 FKBP1A (0.48) ALDH1A1HRH3KMT2AGAA
SCHEMBL770983 0.79 KMT2A (0.54) ALDH1A1KMT2ADPP4SMN1; SMN2LMNA
SCHEMBL17690710 0.79 GAA (0.44) ALDH1A1HRH3KMT2APKMLMNA

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
EP-2439202-B1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 SALVAT LAB SA (ES) 2016-04-20 EP disclosed
US-8822452-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2014-09-02 US disclosed
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US disclosed
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US disclosed
US-8524894-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2013-09-03 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 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 (2 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-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 144/4885HRH3 1687/4885KMT2A 3868/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 142/4885HRH3 1698/4885KMT2A 3893/4885

“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.