SCHEMBL770238

SCHEMBL770238

C[C@@H]1CN(C(=O)CCC(=O)N2CCC3CCCC=C3C2)C[C@H](C)O1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 5/20 0.41
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
FKBP1A P62942 1/20 0.38
PDE4D Q08499 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM1A O60341 1/20 0.37

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
SCHEMBL771318 0.95 ALDH1A1 (0.41) ALDH1A1L3MBTL1KMT2ATP53KDM4E
SCHEMBL769770 0.93 ALDH1A1 (0.40) ALDH1A1L3MBTL1KMT2ATP53KDM4E
SCHEMBL771656 0.87 MAPK1 (0.36) ALDH1A1KMT2AHPGDHTTSMN1; SMN2
SCHEMBL770610 0.87 POLB (0.41) ALDH1A1KMT2AMEN1HPGDTSHR
SCHEMBL771478 0.86 ALDH1A1 (0.38) ALDH1A1L3MBTL1KMT2AKDM4EMEN1
SCHEMBL770939 0.85 NPC1 (0.49) ALDH1A1KMT2AMEN1HPGDSMN1; SMN2
SCHEMBL771940 0.83 KMT2A (0.50) ALDH1A1KMT2AMEN1HPGDSMN1; SMN2
SCHEMBL771285 0.82 KMT2A (0.40) ALDH1A1KMT2AMEN1HPGDHTT
SCHEMBL770877 0.82 NPC1 (0.43) ALDH1A1KMT2AMEN1HPGDHTT
SCHEMBL771900 0.82 ATM (0.39) ALDH1A1L3MBTL1KMT2AMEN1HPGD

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 ALDH1A1 144/4885L3MBTL1 4097/4885KMT2A 3868/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 142/4885L3MBTL1 4090/4885KMT2A 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.