SCHEMBL770000

SCHEMBL770000

O=C(Cc1cccs1)NCCC(=O)N1CCCC2CCCC=C21

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
HSD17B10 Q99714 2/20 0.44
HPGD P15428 5/20 0.43
ALDH1A1 P00352 3/20 0.43
SIGMAR1 Q99720 1/20 0.42
TSHR P16473 1/20 0.42
ALOX15 P16050 1/20 0.40
RAB9A P51151 2/20 0.40
PKM P14618 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
NPC1 O15118 1/20 0.38

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
SCHEMBL770260 0.83 ALDH1A1 (0.46) HPGDALDH1A1SIGMAR1PKMKMT2A
SCHEMBL770707 0.82 SIGMAR1 (0.42) POLBALDH1A1SIGMAR1TSHRRAB9A
SCHEMBL769804 0.80 SIGMAR1 (0.47) HPGDALDH1A1SIGMAR1
SCHEMBL771395 0.80 OPRD1 (0.36) POLBALDH1A1MEN1KMT2A
SCHEMBL770673 0.79 MTNR1A (0.34) HSD17B10HPGDALDH1A1
SCHEMBL771368 0.78 HPGD (0.50) POLBHPGDALDH1A1RAB9AMEN1
SCHEMBL771680 0.78 DPP4 (0.32) ALDH1A1KMT2A
SCHEMBL770508 0.78 MAPT (0.35) POLBALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL769890 0.78 ATM (0.49) HPGDALDH1A1SIGMAR1PKMMEN1
SCHEMBL770298 0.77 GAA (0.46) HSD17B10HPGDALDH1A1ALOX15RAB9A

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 5 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-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 POLB 375/4885HSD17B10 19/4885HPGD 50/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 POLB 358/4885HSD17B10 19/4885HPGD 50/4885

“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.