SCHEMBL770442

SCHEMBL770442

O=C(CCNC(=O)N1CCC2CCCCC2C1)N1CCC2CCCCC2C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.42
LMNA P02545 1/20 0.40
CHRM1 P11229 1/20 0.38
ITGB3 P05106 9/20 0.37
ITGA2B P08514 9/20 0.37
F2R P25116 7/20 0.37
KMT2A Q03164 1/20 0.36
GNAI3 P08754 2/20 0.35
GNAO1 P09471 2/20 0.35
GNAI1 P63096 2/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL770235 0.90 NPC1 (0.49) HSD11B1LMNACHRM1KMT2AGNAI3
SCHEMBL770232 0.90 ALDH1A1 (0.51) LMNACHRM1ITGB3ITGA2BF2R
SCHEMBL770550 0.88 HSD11B1 (0.39) HSD11B1LMNACHRM1ITGB3ITGA2B
SCHEMBL770918 0.88 ITGB3 (0.45) HSD11B1LMNACHRM1ITGB3ITGA2B
SCHEMBL771920 0.85 ITGB3 (0.48) HSD11B1CHRM1ITGB3ITGA2BF2R
SCHEMBL770921 0.85 NPC1 (0.46) HSD11B1LMNAITGB3ITGA2BF2R
SCHEMBL770304 0.85 NPC1 (0.43) HSD11B1LMNAITGB3ITGA2BF2R
SCHEMBL771875 0.85 ATM (0.44) HSD11B1LMNACHRM1ITGB3ITGA2B
SCHEMBL772269 0.85 ATM (0.44) HSD11B1LMNACHRM1ITGB3ITGA2B
SCHEMBL770761 0.85 ATM (0.44) HSD11B1LMNACHRM1ITGB3ITGA2B

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 HSD11B1 1/4885LMNA 3155/4885CHRM1 3030/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885LMNA 3116/4885CHRM1 3021/4885

“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.