SCHEMBL770222

SCHEMBL770222

O=C(NCCC(=O)N1CCCC2CCCC=C21)Nc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
CCR3 P51677 2/20 0.44
TSHR P16473 1/20 0.44
EPHX1 P07099 1/20 0.43
NPSR1 Q6W5P4 1/20 0.41
RAB9A P51151 1/20 0.41
CHRM4 P08173 1/20 0.41
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
BRD4 O60885 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL771768 0.93 CCR3 (0.47) MEN1POLBKMT2ACCR3TSHR
SCHEMBL771894 0.89 LMNA (0.44) CCR3ALDH1A1
SCHEMBL771340 0.89 ALDH1A1 (0.45) KMT2ARAB9AALDH1A1L3MBTL1
SCHEMBL770429 0.86 EPHX1 (0.47) CCR3EPHX1DPP4DPP8DPP7
SCHEMBL770800 0.84 DPP4 (0.47) RAB9ADPP4ALDH1A1L3MBTL1
SCHEMBL771680 0.84 DPP4 (0.32) KMT2ADPP4ALDH1A1
SCHEMBL770260 0.83 ALDH1A1 (0.46) KMT2ACHRM4ALDH1A1L3MBTL1
SCHEMBL770431 0.83 HTR3A (0.48) KMT2ACCR3NPSR1
SCHEMBL771584 0.83 ALDH1A1 (0.47) MEN1KMT2ARAB9AALDH1A1
SCHEMBL771368 0.82 HPGD (0.50) MEN1POLBKMT2ARAB9ADPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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

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 MEN1 827/4885POLB 375/4885KMT2A 3868/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 MEN1 823/4885POLB 358/4885KMT2A 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.