SCHEMBL2525158

SCHEMBL2525158

CCOc1ccc(Cl)cc1OCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
HPGD P15428 2/20 0.56
TACR2 P21452 1/20 0.53
MAPT P10636 4/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
HTR2C P28335 2/20 0.49
HTR2B P41595 2/20 0.49
HTR2A P28223 1/20 0.49
DRD4 P21917 4/20 0.48
ATM Q13315 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP1A2 P05177 3/20 0.47
CYP2D6 P10635 2/20 0.47
GAA P10253 3/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL21596050 0.90 MAPT (0.59) TSHRHPGDMAPTSLC6A2SLC6A4
SCHEMBL3411402 0.86 TSHR (0.49) TSHRHPGDTACR2MAPTSLC6A2
SCHEMBL2477899 0.86 TSHR (0.49) TSHRHPGDTACR2MAPTSLC6A2
SCHEMBL1547765 0.84 TDP1 (0.56) TSHRHPGDMAPTATML3MBTL1
SCHEMBL29483410 0.84 TSHR (0.50) TSHRHPGDMAPTHTR2CHTR2B
SCHEMBL1311327 0.84 TSHR (0.50) TSHRHPGDMAPTHTR2CHTR2B
SCHEMBL10304975 0.83 TSHR (0.49) TSHRHPGDMAPTSLC6A2SLC6A4
SCHEMBL3781671 0.83 MAPT (0.54) TSHRHPGDMAPTHTR2CHTR2B
SCHEMBL254428 0.83 HPGD (0.53) TSHRHPGDMAPTMEN1KMT2A
SCHEMBL14871868 0.82 CYP1A2 (0.56) TSHRHPGDMAPTSLC6A2SLC6A4

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-8039552-B2 Process for producing propylene block copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-18 US disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
US-20100004395-A1 PROCESS FOR PRODUCING PROPYLENE BLOCK COPOLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-07 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 TSHR 1688/4885HPGD 2790/4885TACR2 270/4885

“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.