SCHEMBL4457987

SCHEMBL4457987

CCOP(=O)(OCC)c1cccc(C)c1C

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
POLB P06746 2/20 0.42
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 1/20 0.38
KCNH2 Q12809 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
NLRP3 Q96P20 1/20 0.36
ACHE P22303 1/20 0.35
HTT P42858 1/20 0.35
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NR1I2 O75469 1/20 0.34

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
SCHEMBL4446468 0.86 MEN1 (0.43) KMT2AMEN1MAPTALDH1A1GAA
SCHEMBL15871413 0.85 KMT2A (0.51) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL31482562 0.85 KMT2A (0.54) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL3890445 0.85 KMT2A (0.54) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL4455971 0.83 CYP3A4 (0.41) CYP3A4
SCHEMBL28672462 0.82 MEN1 (0.49) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL9441162 0.82 KMT2A (0.53) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL9441105 0.82 KMT2A (0.49) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL4457990 0.82 ALDH1A1 (0.51) KMT2AMEN1POLBMAPTNPSR1
SCHEMBL18486629 0.80 MEN1 (0.61) KMT2AMEN1POLBNPSR1KCNH2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10550241-B2 Polytrimethylene terephthalate composition, polyester fiber, and methods for producing the same TEIJIN FRONTIER CO., LTD. (JP) 2020-02-04 US disclosed
EP-3249012-B1 POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION, POLYESTER FIBERS, AND METHOD FOR PRODUCING SAME TEIJIN FRONTIER CO LTD (JP) 2019-08-21 EP disclosed
CN-107109040-B Polytrimethylene terephthalate composition, polyester fiber and its manufacturing method 帝人富瑞特株式会社 2019-06-28 CN disclosed
US-20180265667-A1 POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION, POLYESTER FIBER, AND METHODS FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 2018-09-20 US disclosed
CN-106029733-B Polyethylene-2, 6-naphthalate composition having excellent blow moldability and molded article thereof 帝人株式会社 2018-09-07 CN disclosed
US-10017629-B2 Polyethylene-2,6-naphthalate composition with excellent blow moldability, and molded product thereof TEIJIN LIMITED (JP) 2018-07-10 US disclosed
EP-3109271-B1 POLYETHYLENE-2,6-NAPHTHALATE COMPOSITION WITH EXCELLENT BLOW MOLDABILITY, AND MOLDED PRODUCT THEREOF TEIJIN LTD (JP) 2018-03-28 EP disclosed
EP-3249012-A1 POLYTRIMETHYLENE TEREPHTHALATE COMPOSITION, POLYESTER FIBERS, AND METHOD FOR PRODUCING SAME Teijin Limited (JP) 2017-11-29 EP disclosed
CN-107109040-A Polytrimethylene terephthalate composition, polyester fiber and its manufacture method 帝人株式会社 2017-08-29 CN disclosed
EP-3109271-A1 POLYETHYLENE-2,6-NAPHTHALATE COMPOSITION WITH EXCELLENT BLOW MOLDABILITY, AND MOLDED PRODUCT THEREOF Teijin Limited (JP) 2016-12-28 EP disclosed
US-20090163444-A1 PHOSPHO-INDOLES AS HIV INHIBITORS IDENIX PHARMACEUTICALS LLC 2009-06-25 US disclosed
US-20090163444-A1 PHOSPHO-INDOLES AS HIV INHIBITORS IDENIX PHARMACEUTICALS LLC 2009-06-25 US disclosed
US-7534809-B2 Phospho-indoles as HIV inhibitors IDENIX PHARMACEUTICALS, INC. (US) 2009-05-19 US disclosed
US-7534809-B2 Phospho-indoles as HIV inhibitors IDENIX PHARMACEUTICALS, INC. (US) 2009-05-19 US disclosed
EP-1961757-A1 Phosphoindoles as HIV inhibitors IDENIX Pharmaceuticals, Inc. (US) 2008-08-27 EP disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed
EP-0391415-B1 Naphthalocyanine compounds and production thereof ORIENT CHEMICAL IND (JP) 1995-03-29 EP disclosed
US-5149847-A Phosphoryl-substituted 2,3-dicyanonaphthalene intermediate ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1992-09-22 US disclosed
US-5064951-A NAPHTHALOCYANINE COMPOUND AND PRODUCTION THEREOF ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1991-11-12 US disclosed
EP-0391415-A2 Naphthalocyanine compounds and production thereof ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1990-10-10 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-20090163444-A1 PHOSPHO-INDOLES AS HIV INHIBITORS IDO1, PPP5C, INMT KMT2A 1767/4885MEN1 3483/4885POLB 712/4885

“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.