SCHEMBL1441802

SCHEMBL1441802

COc1cc(OC)c(C(=O)CCCCCBr)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
CYP3A4 P08684 1/20 0.46
HDAC8 Q9BY41 1/20 0.44
HDAC1 Q13547 1/20 0.44
HMGCR P04035 1/20 0.42
HTR4 Q13639 2/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
PAX8 Q06710 1/20 0.41
MEN1 O00255 2/20 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
SCHEMBL9972448 0.88 HDAC8 (0.43) KMT2AHDAC8HDAC1HTR4MEN1
SCHEMBL9116393 0.88 HMGCR (0.59) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL9115089 0.88 HMGCR (0.59) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL1441269 0.88 HMGCR (0.59) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL27200200 0.88 CTNNB1 (0.43) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL9117235 0.88 HMGCR (0.59) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL9506703 0.86 HDAC8 (0.42) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL9116037 0.86 HMGCR (0.61) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL8574455 0.82 KMT2A (0.50) KMT2ACYP3A4HDAC8HDAC1HMGCR
SCHEMBL7267209 0.82 MAPT (0.55) KMT2AHDAC8HDAC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546402-B2 Chromone derivatives, a process for their preparation and their therapeutic applications SOKOLOFF PIERRE (FR) 2013-10-01 US disclosed
US-8546402-B2 Chromone derivatives, a process for their preparation and their therapeutic applications SOKOLOFF PIERRE (FR) 2013-10-01 US disclosed
EP-2470520-B1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS PF MEDICAMENT (FR) 2013-07-17 EP disclosed
EP-2470520-A1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS Pierre Fabre Medicament (FR) 2012-07-04 EP disclosed
US-20120157463-A1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS PIERRE FABRE MEDICAMENT (FR) 2012-06-21 US disclosed
US-20120157463-A1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS PIERRE FABRE MEDICAMENT (FR) 2012-06-21 US disclosed
WO-2011027289-A1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS PIERRE FABRE MEDICAMENT (FR) 2011-03-10 WO disclosed
WO-2011027289-A1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS PIERRE FABRE MEDICAMENT (FR) 2011-03-10 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-20120157463-A1 CHROMONE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATIONS CHRNA3, CHRM3, VDR KMT2A 3560/4885CYP3A4 115/4885HDAC8 2707/4885

“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.