SCHEMBL2493216

SCHEMBL2493216

CCOP(=O)(OCC)c1cscc1P(=O)(OCC)OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.35
KCNH2 Q12809 1/20 0.34
ACHE P22303 1/20 0.32
PPARD Q03181 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
NR1I2 O75469 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL2493153 0.87 CYP3A4 (0.44) POLBMEN1KMT2ATSHR
SCHEMBL2493025 0.87 CYP3A4 (0.44) POLBMEN1KMT2ATSHR
SCHEMBL2498089 0.86 POLB (0.42) POLBMEN1KMT2ATSHRTDP1
SCHEMBL14311053 0.85 POLB (0.38) POLBMEN1KMT2ATSHRTDP1
SCHEMBL2490786 0.84 LPAR3 (0.44) POLBMEN1KMT2AKCNH2
SCHEMBL2494184 0.84 LPAR3 (0.44) POLBMEN1KMT2AKCNH2
SCHEMBL12191705 0.82 CYP3A4 (0.39) POLBMEN1KMT2A
SCHEMBL12191704 0.79 LPAR3 (0.40) POLBMEN1KMT2AKCNH2
SCHEMBL2494369 0.77 LPAR3 (0.48) KCNH2
SCHEMBL2491641 0.77 LPAR3 (0.48) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1882694-B1 OLIGOMERS AND POLYMERS OF THIOPHENE COMPOUNDS HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME NISSAN CHEMICAL IND LTD (JP) 2013-04-03 EP disclosed
US-8030438-B2 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-10-04 US disclosed
US-8030438-B2 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-10-04 US disclosed
US-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2010-01-28 US disclosed
US-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2010-01-28 US disclosed
EP-1882694-A1 THIOPHENE COMPOUND HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-01-30 EP disclosed
US-7307037-B2 Metallic catalysts for chemo-, regio- and stereoselective reactions, and corresponding precursors CHEMI S.P.A. (IT) 2007-12-11 US disclosed
US-20050107248-A1 Metallic catalysts for chemo-, regio-and stereoselective reactions, and corresponding precursors CHEMI S.P.A. (IT) 2005-05-19 US disclosed
EP-1490173-A2 METALORGANIC CATALYSTS FOR CHEMO-, REGIO- AND STEREOSELECTIVE REACTIONS, AND CORRESPONDING PRECURSORS CHEMI S.p.A. (IT) 2004-12-29 EP disclosed
WO-2003074169-A2 METALORGANIC CATALYSTS FOR CHEMO-, REGIO- AND STEREOSELECTIVE REACTIONS, AND CORRESPONDING PRECURSORS CHEMI S.P.A. (IT) 2003-09-12 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-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same RRP12, NR2E1, TST POLB 1838/4885MEN1 4275/4885KMT2A 4579/4885
US-20050107248-A1 Metallic catalysts for chemo-, regio-and stereoselective reactions, and corresponding precursors PHOSPHO1, OSTC, MAS1 POLB 408/4885MEN1 465/4885KMT2A 3718/4885

“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.