SCHEMBL770899

SCHEMBL770899

O=C(CCNC(=O)C1(c2ccccc2)CC1)N1CCC2CCCCC2C1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
HTT P42858 1/20 0.48
HSD11B1 P28845 7/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CHRM5 P08912 1/20 0.41
CHRM3 P20309 1/20 0.41
RAB9A P51151 1/20 0.40
OPRL1 P41146 3/20 0.40
OPRM1 P35372 1/20 0.39

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
SCHEMBL771125 0.97 SMN1; SMN2 (0.53) SMN1; SMN2HTTALDH1A1LMNANPSR1
SCHEMBL770940 0.96 SMN1; SMN2 (0.52) SMN1; SMN2HTTHSD11B1ALDH1A1LMNA
SCHEMBL772069 0.86 HSD11B1 (0.46) HSD11B1LMNA
SCHEMBL769894 0.85 SMN1; SMN2 (0.40) SMN1; SMN2HTTALDH1A1L3MBTL1RAB9A
SCHEMBL770493 0.81 KDM4E (0.53) SMN1; SMN2HTTALDH1A1CHRM5CHRM3
SCHEMBL771597 0.79 ALDH1A1 (0.49) SMN1; SMN2HSD11B1ALDH1A1L3MBTL1
SCHEMBL770715 0.78 SMN1; SMN2 (0.54) SMN1; SMN2HTTHSD11B1ALDH1A1LMNA
SCHEMBL770415 0.77 SMN1; SMN2 (0.53) SMN1; SMN2HTTALDH1A1LMNANPSR1
SCHEMBL770442 0.77 HSD11B1 (0.42) HSD11B1LMNA
SCHEMBL771711 0.76 LMNA (0.49) SMN1; SMN2ALDH1A1LMNAL3MBTL1

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 SMN1; SMN2 3653/4885HTT 412/4885HSD11B1 1/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 SMN1; SMN2 3637/4885HTT 425/4885HSD11B1 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.