SCHEMBL770489

SCHEMBL770489

CN(Cc1ccccc1)C(=O)CCNC(=O)N1CCC2CCCCC2C1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 2/20 0.47
KMT2A Q03164 2/20 0.44
MAPK1 P28482 2/20 0.42
GLA P06280 1/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EPHX2 P34913 1/20 0.40

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
SCHEMBL769722 0.94 NPC1 (0.46) NPC1RAB9AKMT2AMAPK1JAK2
SCHEMBL771254 0.83 NPC1 (0.54) NPC1RAB9AKMT2AMAPK1JAK2
SCHEMBL771035 0.82 CHRM1 (0.40) POLBL3MBTL1
SCHEMBL771069 0.82 NPC1 (0.51) NPC1RAB9AKMT2AMAPK1GLA
SCHEMBL770386 0.81 HRH3 (0.54) NPC1RAB9AKMT2AMEN1
SCHEMBL771290 0.80 LMNA (0.41) POLBL3MBTL1
SCHEMBL769940 0.79 SIGMAR1 (0.43) KMT2AMAPK1MEN1
SCHEMBL770438 0.78 NAMPT (0.62) L3MBTL1EPHX2
SCHEMBL10138022 0.78 ALDH1A1 (0.41) KMT2AMEN1L3MBTL1
SCHEMBL770384 0.77 HRH3 (0.52) NPC1RAB9AKMT2AMEN1

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 2187/4885KMT2A 3868/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 NPC1 104/4885RAB9A 2217/4885KMT2A 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.