SCHEMBL769712

SCHEMBL769712

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

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.57
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 4/20 0.44
HPGD P15428 3/20 0.44
MEN1 O00255 3/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 3/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
ATM Q13315 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL769997 0.97 NPC1 (0.54) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770939 0.95 NPC1 (0.49) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL769789 0.92 NPC1 (0.42) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770997 0.90 ATM (0.47) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770075 0.90 ALDH1A1 (0.42) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770401 0.90 LMNA (0.39) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770877 0.89 NPC1 (0.43) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL771078 0.89 NPC1 (0.42) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770549 0.88 KMT2A (0.54) NPC1ALDH1A1KMT2AHPGDMEN1
SCHEMBL770381 0.87 ITGB3 (0.41) NPC1ALDH1A1HPGDLMNASMN1; SMN2

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