SCHEMBL5362347

SCHEMBL5362347

CC1CN(c2cc3c(cc2F)c(=O)c(-c2noc(C(C)(C)c4ccccc4)n2)cn3Cc2ccc(C(F)(F)F)cc2)CC(C)O1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 5/20 0.40
THRB P10828 5/20 0.39
LMNA P02545 1/20 0.38
HDAC6 Q9UBN7 3/20 0.36
HDAC5 Q9UQL6 3/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC8 Q9BY41 2/20 0.36

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
SCHEMBL5356883 0.95 LMNA (0.40) TOP1THRBLMNAHDAC6HDAC1
SCHEMBL5349328 0.92 TOP1 (0.41) TOP1THRBLMNAHDAC6HDAC5
SCHEMBL5356562 0.89 THRB (0.52) THRBLMNA
SCHEMBL5349278 0.88 THRB (0.42) THRBLMNA
SCHEMBL5358736 0.88 THRB (0.42) THRBLMNAHDAC6HDAC5HDAC1
SCHEMBL5353229 0.88 LMNA (0.40) TOP1THRBLMNAHDAC6HDAC1
SCHEMBL5357545 0.87 THRB (0.43) TOP1THRBLMNA
SCHEMBL5456981 0.87 THRB (0.43) TOP1THRBLMNA
SCHEMBL5370616 0.86 THRB (0.40) TOP1THRBLMNA
SCHEMBL5456996 0.85 HDAC6 (0.41) HDAC6HDAC5HDAC1HDAC8

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-20070287699-A1 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-12-13 US disclosed
US-20070287699-A1 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-12-13 US disclosed
US-20070287699-A1 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-12-13 US disclosed
WO-2007130499-A2 ANTIVIRAL AGENTS VIROBAY, INC. (US) 2007-11-15 WO 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-20070287699-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 TOP1 740/4885THRB 4510/4885LMNA 4460/4885

“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.