SCHEMBL794610

SCHEMBL794610

O=C(N1CCCC2CCCCC21)N1CCCC2CCCCC21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
POLB P06746 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
HSD11B1 P28845 7/20 0.43
HSD17B1 P14061 1/20 0.42
F13A1 P00488 1/20 0.42
TGM2 P21980 1/20 0.42
TGM1 P22735 1/20 0.42
DPP7 Q9UHL4 1/20 0.41
CNR2 P34972 1/20 0.40
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC18A3 Q16572 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL770763 0.86 NPC1 (0.53) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL2824467 0.84 NPC1 (0.56) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL771967 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL3264155 0.83 POLB (0.53) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL13010235 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL938422 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL18312214 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL769748 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL12335228 0.83 POLB (0.53) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL6806462 0.82 L3MBTL3 (0.41) NPC1RAB9ASMN1; SMN2POLBTDP1

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 11 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-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
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 US disclosed
WO-2010139827-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2010-12-09 WO disclosed
CN-100366606-C New phenylamidine derivatives process for preparing the same and their use as medicaments BOEHRINGER INGELHEIM KG (DE) 2008-02-06 CN disclosed
CN-1072663-C benzoylguanidine derivatives, process for their preparation and their use in the preparation of pharmaceutical compositions BOEHRINGER INTELLEIM KG (DE) 2001-10-10 CN disclosed
CN-1208409-A Novel benzoyl guanidine derivatives process for their preparation and their use in the preparation of medicines BOEHRINGER INGELHEIM KG (DE) 1999-02-17 CN disclosed
CN-1204315-A Novel phenylamidine derivatives, process for preparing same and use thereof as pharmaceutical composition BOEHRINGER INGELHEIM KG (DE) 1999-01-06 CN 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.