SCHEMBL794294

SCHEMBL794294

CCNC(=O)CN(CCc1c[nH]c2ccc(OC)cc12)C(=O)CCCC(=O)N1CCCC2CCCCC21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.46
ACHE P22303 4/20 0.45
MTNR1A P48039 6/20 0.44
MTNR1B P49286 5/20 0.44
TRPV1 Q8NER1 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL771752 0.90 KMT2A (0.45) BCHEACHEMTNR1AMTNR1BTRPV1
SCHEMBL770772 0.84 MTNR1A (0.65) BCHEACHEMTNR1AMTNR1BTRPV1
SCHEMBL15245593 0.81 HTR2A (0.53) MTNR1AMTNR1BTRPV1KMT2AALDH1A1
SCHEMBL771003 0.81 BCHE (0.43) BCHEACHETRPV1ALDH1A1KDM4E
SCHEMBL772067 0.79 SMN1; SMN2 (0.48) ALDH1A1KDM4EMAPTLMNA
SCHEMBL771429 0.77 ALDH1A1 (0.46) ALDH1A1
SCHEMBL771753 0.74 KMT2A (0.44) BCHEACHEMTNR1AMTNR1BTRPV1
SCHEMBL770266 0.73 FKBP1A (0.40) KMT2AALDH1A1
SCHEMBL770192 0.72 TRPV1 (0.58) BCHEACHEMTNR1AMTNR1BTRPV1
SCHEMBL771224 0.71 KDM4E (0.41) ALDH1A1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 BCHE 291/4885ACHE 677/4885MTNR1A 1777/4885

“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.