SCHEMBL2472830

SCHEMBL2472830

COC(=O)c1c(O)c2ccc(-c3ccc(C(F)(F)F)cc3)cc2sc1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.42
CISD2 Q8N5K1 1/20 0.39
SLC6A2 P23975 1/20 0.39
P2RY14 Q15391 1/20 0.39
KIF11 P52732 1/20 0.38
CFTR P13569 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CRHBP P24387 1/20 0.36
KMT2A Q03164 1/20 0.36
CRHR2 Q13324 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GSK3B P49841 1/20 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
SCHEMBL3394064 0.92 RXRA (0.39) ESR1CISD2CFTRL3MBTL1MAPT
SCHEMBL2474677 0.87 IKBKB (0.42) ESR1L3MBTL1MAPTTDP1KDM4E
SCHEMBL2475619 0.85 ESR1 (0.41) ESR1CISD2L3MBTL1MAPTTDP1
SCHEMBL2471918 0.85 EGFR (0.45) L3MBTL1MAPTTDP1KDM4EMEN1
SCHEMBL2471066 0.84 L3MBTL1 (0.53) L3MBTL1MAPTTDP1KDM4EALDH1A1
SCHEMBL3397945 0.83 L3MBTL1 (0.40) CFTRL3MBTL1MAPTNPSR1TDP1
SCHEMBL2470737 0.82 ESR1 (0.38) ESR1L3MBTL1TDP1ALDH1A1
SCHEMBL2468601 0.81 GSK3A (0.46) ESR1L3MBTL1GSK3B
SCHEMBL2470728 0.81 TP53 (0.41) L3MBTL1MAPTTDP1KDM4EMEN1
SCHEMBL2474041 0.81 PIK3CA (0.40) L3MBTL1MAPTNPSR1TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370422-B1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS FIBROGEN INC (US) 2019-06-05 EP disclosed
US-9149476-B2 Thiochromene derivatives as HIF hydroxylase inhibitors FIBROGEN, INC. (US) 2015-10-06 US disclosed
US-20150182528-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS FIBROGEN, INC. 2015-07-02 US disclosed
US-8927591-B2 Thiochromene derivatives as HIF hydroxylase inhibitors FIBROGEN, INC. (US) 2015-01-06 US disclosed
US-20110305776-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS FIBROGEN, INC. (US) 2011-12-15 US disclosed
EP-2370422-A1 THIOCHROMENE DERIVATIVES AS HIP HYDROXYLASE INHIBITORS Fibrogen, Inc. (US) 2011-10-05 EP disclosed
WO-2010056767-A1 THIOCHROMENE DERIVATIVES AS HIP HYDROXYLASE INHIBITORS FIBROGEN, INC. (US) 2010-05-20 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-20110305776-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS HIF1AN, HIF1A, EGLN2 ESR1 1356/4885CISD2 88/4885SLC6A2 3707/4885
US-20150182528-A1 THIOCHROMENE DERIVATIVES AS HIF HYDROXYLASE INHIBITORS HIF1AN, HIF1A, EGLN2 ESR1 1356/4885CISD2 88/4885SLC6A2 3707/4885

“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.