SCHEMBL9903728

SCHEMBL9903728

CCOC(=O)[C@H]1[C@@H]2Cc3cc(OCc4c(F)ccc(-c5c(Cl)cccc5Cl)c4C)ccc3[C@@H]21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 2/20 0.38
TSHR P16473 2/20 0.38
NR1H4 Q96RI1 8/20 0.38
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
FFAR1 O14842 3/20 0.37
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL13222684 0.91 FFAR1 (0.44) POLBNR1H4HPGDFFAR1
SCHEMBL3053045 0.91 FFAR1 (0.44) POLBNR1H4HPGDFFAR1
SCHEMBL13222719 0.85 FFAR1 (0.36) SMN1; SMN2POLBKDM4ETSHRALDH1A1
SCHEMBL13243700 0.85 NR1H4 (0.36) SMN1; SMN2POLBKDM4ENR1H4KMT2A
SCHEMBL13243314 0.85 NR1H4 (0.36) SMN1; SMN2POLBKDM4ENR1H4KMT2A
SCHEMBL29423934 0.81 FFAR1 (0.35) SMN1; SMN2POLBKDM4ETSHRALDH1A1
SCHEMBL16846001 0.81 FFAR1 (0.35) SMN1; SMN2POLBKDM4ETSHRALDH1A1
SCHEMBL9903732 0.78 NR1H4 (0.38) POLBNR1H4HPGDFFAR1
SCHEMBL29423905 0.77 FFAR1 (0.42) POLBKMT2AMEN1FFAR1
SCHEMBL29423928 0.77 FFAR1 (0.42) POLBKMT2AMEN1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399507-B2 Antidiabetic tricyclic compounds MERCK SHARP & DOHME CORP. (US) 2013-03-19 US disclosed
EP-2215068-B1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME (US) 2012-06-13 EP disclosed
EP-2215068-B1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME (US) 2012-06-13 EP disclosed
US-20100216694-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC 2010-08-26 US disclosed
WO-2009058237-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK & CO., INC. (US) 2009-05-07 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-20100216694-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS GPR119, GPR65, GPR55 SMN1; SMN2 4810/4885POLB 4681/4885KDM4E 3385/4885

“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.