SCHEMBL17276348

SCHEMBL17276348

COC(=O)c1ccc2c(c1)C(O)(c1ccccc1C(F)(F)F)CC2

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.52
NOTUM Q6P988 1/20 0.46
HDAC4 P56524 1/20 0.41
RBP4 P02753 1/20 0.41
TRPA1 O75762 3/20 0.40
SYK P43405 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
P4HB P07237 1/20 0.38
CYP3A4 P08684 1/20 0.37
ESRRA P11474 1/20 0.37

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
SCHEMBL17276193 0.85 PDK2 (0.45) PDK2HDAC4SYKMRGPRX4
SCHEMBL17276114 0.83 PDK2 (0.39) PDK2HDAC4RBP4SYK
SCHEMBL17276575 0.82 PDK2 (0.48) PDK2NOTUMHDAC4RBP4
SCHEMBL6285519 0.78 HDAC4 (0.44) PDK2HDAC4
SCHEMBL17276351 0.76 PDK2 (0.44) PDK2HDAC4
SCHEMBL24401017 0.76 PDK2 (0.48) PDK2NOTUMTRPA1CYP3A4
SCHEMBL17275591 0.73 HDAC4 (0.40) NOTUMHDAC4SYK
SCHEMBL17276159 0.71 HDAC4 (0.39) PDK2HDAC4CYP3A4
SCHEMBL17276141 0.70 RBP4 (0.53) PDK2NOTUMRBP4TRPA1CYP3A4
SCHEMBL17276154 0.70 MEN1 (0.55) PDK2NOTUMRBP4

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
EP-3145915-B1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC (US) 2025-03-19 EP disclosed
US-10000454-B2 Antidiabetic tricyclic compounds MERCK SHARP & DOHME (US) 2018-06-19 US disclosed
US-20170081287-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC 2017-03-23 US disclosed
WO-2015176267-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2015-11-26 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 (2 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-10000454-B2 Antidiabetic tricyclic compounds GPR119, GPR65, GPR52 PDK2 1684/4885NOTUM 1389/4885HDAC4 549/4885
US-20170081287-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS GPR119, GPR65, GPR52 PDK2 1684/4885NOTUM 1389/4885HDAC4 549/4885

“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.