SCHEMBL15445361

SCHEMBL15445361

CC(C)(C)OC(C(=O)O)C1=C(c2ccc3c(c2)CCCO3)c2ccccc2CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 4/20 0.39
WNT3A P56704 4/20 0.39
CYP3A4 P08684 1/20 0.39
FABP4 P15090 3/20 0.38
NR1I2 O75469 1/20 0.36
STING1 Q86WV6 2/20 0.36
PSIP1 O75475 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
SLC6A9 P48067 1/20 0.35
NOTUM Q6P988 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
SCHEMBL15441306 0.90 FABP4 (0.39) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL13269540 0.83 CYP3A4 (0.43) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL13193329 0.81 CTNNB1 (0.37) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL15441320 0.80 PSIP1 (0.41) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL15441495 0.79 CTNNB1 (0.37) CTNNB1WNT3ACYP3A4FABP4SLC6A9
SCHEMBL13465224 0.79 CYP3A4 (0.41) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL13465471 0.79 FABP4 (0.43) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL15441423 0.79 CYP3A4 (0.43) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL13269068 0.77 CYP3A4 (0.39) CTNNB1WNT3ACYP3A4FABP4NR1I2
SCHEMBL13465458 0.77 PSIP1 (0.36) CTNNB1WNT3ACYP3A4FABP4NR1I2

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-9604900-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses LABORATOIRE BIODIM (FR) 2017-03-28 US disclosed
US-9604900-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses LABORATOIRE BIODIM (FR) 2017-03-28 US disclosed
US-20140031338-A1 INHIBITORS OF VIRAL REPLICATION, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES LABORATOIRE BIODIM (FR) 2014-01-30 US disclosed
US-20140031338-A1 INHIBITORS OF VIRAL REPLICATION, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES LABORATOIRE BIODIM (FR) 2014-01-30 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-20140031338-A1 INHIBITORS OF VIRAL REPLICATION, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES POLRMT, MAVS, EIF2AK2 CTNNB1 3907/4885WNT3A 3567/4885CYP3A4 2282/4885

“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.