SCHEMBL14866176

SCHEMBL14866176

CCOC(=O)c1cccc(CN2C(=O)CCc3cc(-c4ccc(C)cc4)ccc32)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.45
HDAC1 Q13547 3/20 0.44
HDAC8 Q9BY41 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
SRD5A1 P18405 1/20 0.42
SRD5A2 P31213 1/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
ACMSD Q8TDX5 1/20 0.42
LMNA P02545 1/20 0.41
ALOX5 P09917 1/20 0.41

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
SCHEMBL3308461 0.91 MAPT (0.48) ACHEHDAC1HDAC8HDAC6SRD5A1
SCHEMBL14866043 0.88 KMT2A (0.49) HDAC1HDAC8HDAC6CYP1A2CYP11B1
SCHEMBL14866095 0.78 HDAC6 (0.55) HDAC1HDAC8HDAC6CYP1A2CYP11B1
SCHEMBL14865935 0.77 HDAC6 (0.49) HDAC1HDAC8HDAC6SRD5A1CYP1A2
SCHEMBL3304528 0.76 PRKAG1 (0.49) HDAC1HDAC8HDAC6
SCHEMBL14865940 0.76 CYP1A2 (0.45) HDAC1HDAC8HDAC6CYP1A2CYP11B1
SCHEMBL5863231 0.73 TP53 (0.56) CYP4F2CYP4A11LMNA
SCHEMBL14865932 0.73 HTT (0.48) SRD5A1CYP1A2CYP11B1CYP11B2LMNA
SCHEMBL13330272 0.73 HSP90AA1 (0.53) HDAC1HDAC8HDAC6CYP1A2CYP11B1
SCHEMBL17067758 0.71 POLB (0.68) HDAC1HDAC8HDAC6CYP1A2

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-8952007-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2015-02-10 US disclosed
US-8664379-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2014-03-04 US disclosed
US-20130096122-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES, INC. (US) 2013-04-18 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-20130096122-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, KCNH2, CACNA1E ACHE 1802/4885HDAC1 265/4885HDAC8 1084/4885

“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.