SCHEMBL771376

SCHEMBL771376

CCCCN(C)C(=O)CCNC(=O)N1CCCC2CCCCC21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
POLB P06746 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 2/20 0.34
EPHX2 P34913 2/20 0.33
HSD11B1 P28845 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 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
SCHEMBL771425 0.94 NPSR1 (0.40) NPC1RAB9ASMN1; SMN2NPSR1SIGMAR1
SCHEMBL770849 0.93 NPC1 (0.41) NPC1RAB9ASMN1; SMN2NPSR1POLB
SCHEMBL771774 0.89 NPC1 (0.40) NPC1RAB9ASMN1; SMN2NPSR1POLB
SCHEMBL771173 0.88 NPC1 (0.43) NPC1RAB9ASMN1; SMN2NPSR1POLB
SCHEMBL769970 0.82 SIGMAR1 (0.38) NPC1RAB9ASMN1; SMN2SIGMAR1POLB
SCHEMBL770181 0.82 EPHX2 (0.40) SIGMAR1POLBEPHX2MEN1KMT2A
SCHEMBL770795 0.81 NPC1 (0.43) NPC1RAB9ASMN1; SMN2SIGMAR1POLB
SCHEMBL17690700 0.80 SIGMAR1 (0.36) NPC1RAB9ASMN1; SMN2SIGMAR1POLB
SCHEMBL794594 0.80 SIGMAR1 (0.36) NPC1RAB9ASMN1; SMN2SIGMAR1POLB
SCHEMBL771069 0.79 NPC1 (0.51) NPC1RAB9ASMN1; SMN2POLBEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 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 NPC1 97/4885RAB9A 2187/4885SMN1; SMN2 3653/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 NPC1 104/4885RAB9A 2217/4885SMN1; SMN2 3637/4885

“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.