SCHEMBL770075

SCHEMBL770075

CC1CCN(C(=O)CC(=O)N2CCC3CCCC=C3C2)CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
NPC1 O15118 4/20 0.42
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
HPGD P15428 4/20 0.37
RAB9A P51151 3/20 0.37
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 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
SCHEMBL770939 0.92 NPC1 (0.49) ALDH1A1NPC1KMT2AMEN1SMN1; SMN2
SCHEMBL769997 0.90 NPC1 (0.54) ALDH1A1NPC1KMT2AMEN1SMN1; SMN2
SCHEMBL769712 0.90 NPC1 (0.57) ALDH1A1NPC1KMT2AMEN1SMN1; SMN2
SCHEMBL770397 0.89 ALDH1A1 (0.36) ALDH1A1NPC1KMT2ASMN1; SMN2HPGD
SCHEMBL770293 0.89 KMT2A (0.37) ALDH1A1KMT2AMEN1HPGDLMNA
SCHEMBL770894 0.88 KDM1A (0.39) ALDH1A1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL769880 0.88 ALDH1A1 (0.47) ALDH1A1NPC1KMT2AMEN1SMN1; SMN2
SCHEMBL769770 0.85 ALDH1A1 (0.40) ALDH1A1KMT2ASMN1; SMN2HPGDL3MBTL1
SCHEMBL770485 0.85 ACHE (0.38) ALDH1A1NPC1KMT2AMEN1SMN1; SMN2
SCHEMBL770666 0.85 RBP4 (0.44) ALDH1A1NPC1SMN1; SMN2RAB9A

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 144/4885NPC1 97/4885KMT2A 3868/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 142/4885NPC1 104/4885KMT2A 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.