SCHEMBL770312

SCHEMBL770312

COC(=O)CN(Cc1ccccc1C(F)(F)F)C(=O)CCCC(=O)N1CCCC2CCCC=C21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.38
EPHX2 P34913 1/20 0.36
SLC6A2 P23975 4/20 0.35
SLC6A4 P31645 4/20 0.35
SLC6A3 Q01959 1/20 0.35
PGR P06401 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ACHE P22303 2/20 0.34
ACKR3 P25106 2/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34

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
SCHEMBL769726 0.81 KDM4E (0.41) KDM4EALDH1A1KMT2ACHRNB2CHRNA4
SCHEMBL770311 0.80 KDM4E (0.39) KDM4EALDH1A1MAPTEPHX2SLC6A2
SCHEMBL771357 0.74 OPRM1 (0.41) KDM4EALDH1A1KMT2ACHRNB2CHRNA4
SCHEMBL771018 0.74 ALDH1A1 (0.40) ALDH1A1MAPTEPHX2CYP2D6CYP2C9
SCHEMBL772447 0.73 ALDH1A1 (0.41) ALDH1A1CYP2D6CYP2C9
SCHEMBL770279 0.73 ALDH1A1 (0.41) ALDH1A1MAPTCYP2D6CYP2C9MEN1
SCHEMBL770616 0.71 MAPT (0.36) MAPTMEN1KMT2A
SCHEMBL770267 0.71 ALOX5 (0.38) ALDH1A1MAPTCYP2D6CYP2C9MEN1
SCHEMBL772068 0.70 SMN1; SMN2 (0.46) KDM4EALDH1A1MAPTCYP2D6CYP2C9
SCHEMBL770945 0.69 NAAA (0.36) MAPTCYP2D6CYP2C9MEN1KMT2A

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-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 (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 KDM4E 4127/4885ALDH1A1 142/4885MAPT 638/4885

“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.