SCHEMBL15380801

SCHEMBL15380801

O=C(CCCS(=O)(=O)N1CCC2CCCCC2C1)N1CCCC(O)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
ATM Q13315 2/20 0.34
CYP1A2 P05177 2/20 0.33
CNR2 P34972 1/20 0.33
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL770923 1.00 KMT2A (0.39) KMT2AMEN1POLBMAPTCHRM2
SCHEMBL770724 0.89 HSD11B1 (0.40) KMT2AMEN1POLBMAPTATM
SCHEMBL771014 0.88 CNR2 (0.41) KMT2AMEN1POLBMAPTCHRM2
SCHEMBL770957 0.87 ATM (0.45) KMT2AMEN1POLBMAPTATM
SCHEMBL771024 0.87 ATM (0.45) KMT2AMEN1POLBMAPTATM
SCHEMBL772379 0.87 ATM (0.45) KMT2AMEN1POLBMAPTATM
SCHEMBL770513 0.87 KMT2A (0.56) KMT2AMEN1POLBMAPTCHRM2
SCHEMBL17690708 0.82 KMT2A (0.42) KMT2AMEN1POLBMAPTCHRM2
SCHEMBL771724 0.82 CHRM2 (0.39) KMT2AMEN1POLBMAPTCHRM2
SCHEMBL771725 0.82 CHRM2 (0.39) KMT2AMEN1POLBMAPTCHRM2

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 2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 KMT2A 3868/4885MEN1 827/4885POLB 375/4885

“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.