SCHEMBL771894

SCHEMBL771894

O=C(NCCC(=O)N1CCCC2CCCC=C21)Nc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HTR3A P46098 1/20 0.43
CCR3 P51677 9/20 0.42
RECQL P46063 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CCR2 P41597 1/20 0.41
EPHX2 P34913 1/20 0.40
FPR2 P25090 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
SCHEMBL770431 0.93 HTR3A (0.48) LMNAHTR3ACCR3CCR2
SCHEMBL770222 0.89 MEN1 (0.46) CCR3ALDH1A1
SCHEMBL771768 0.82 CCR3 (0.47) LMNAHTR3ACCR3ALDH1A1KDM4E
SCHEMBL771680 0.80 DPP4 (0.32) LMNAALDH1A1
SCHEMBL770028 0.79 KMT2A (0.33) LMNAKDM4EEPHX2
SCHEMBL771340 0.79 ALDH1A1 (0.45) LMNAALDH1A1KDM4E
SCHEMBL770410 0.78 CACNA1H (0.39) LMNAALDH1A1
SCHEMBL770637 0.78 EPHX1 (0.48) CCR3ALDH1A1KDM4EEPHX2
SCHEMBL771010 0.78 EPHX1 (0.48) CCR3ALDH1A1KDM4EEPHX2
SCHEMBL770429 0.78 EPHX1 (0.47) LMNACCR3ALDH1A1EPHX2

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 LMNA 3155/4885HTR3A 1502/4885CCR3 3880/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 LMNA 3116/4885HTR3A 1501/4885CCR3 3869/4885

“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.