SCHEMBL770982

SCHEMBL770982

CC1CCN(C(=O)CCCNC(=O)N2CCCC3CCCCC32)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
ALDH1A1 P00352 5/20 0.44
HSD11B1 P28845 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.40
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
DPP4 P27487 2/20 0.38
EPHX2 P34913 2/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL770958 0.93 ALDH1A1 (0.47) NPC1ALDH1A1HSD11B1MEN1KMT2A
SCHEMBL770598 0.89 NPC1 (0.44) NPC1HSD11B1MEN1KMT2ARAB9A
SCHEMBL772486 0.89 NPC1 (0.44) NPC1HSD11B1MEN1KMT2ARAB9A
SCHEMBL770491 0.89 NPC1 (0.44) NPC1HSD11B1MEN1KMT2ARAB9A
SCHEMBL770587 0.88 KMT2A (0.42) NPC1ALDH1A1HSD11B1MEN1KMT2A
SCHEMBL770765 0.88 KMT2A (0.54) NPC1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL772280 0.86 NPC1 (0.48) NPC1RAB9ASMN1; SMN2DPP4EPHX2
SCHEMBL770310 0.86 NPC1 (0.44) NPC1HSD11B1MEN1KMT2ARAB9A
SCHEMBL770470 0.85 NPC1 (0.64) NPC1ALDH1A1HSD11B1MEN1KMT2A
SCHEMBL770969 0.85 NPC1 (0.59) NPC1ALDH1A1HSD11B1MEN1KMT2A

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
EP-2439202-B1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 SALVAT LAB SA (ES) 2016-04-20 EP disclosed
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 97/4885ALDH1A1 144/4885HSD11B1 1/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 NPC1 104/4885ALDH1A1 142/4885HSD11B1 1/4885

“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.