SCHEMBL3263841

SCHEMBL3263841

c1coc(-c2nc(-c3ncco3)no2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.63
NPC1 O15118 10/20 0.63
HSD17B10 Q99714 8/20 0.63
SMN1; SMN2 Q16637 7/20 0.63
TP53 P04637 4/20 0.63
POLB P06746 3/20 0.63
PKM P14618 2/20 0.63
TSHR P16473 4/20 0.62
ALDH1A1 P00352 7/20 0.57
CASP3 P42574 1/20 0.56
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPK1 P28482 2/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
MAPT P10636 7/20 0.49
RECQL P46063 2/20 0.48
KDM4E B2RXH2 7/20 0.44
HPGD P15428 6/20 0.44

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
SCHEMBL3980455 0.82 ALDH1A1 (0.48) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL2458259 0.77 NPC1 (1.00) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL13930846 0.76 NPC1 (0.76) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL13930818 0.73 CASP3 (0.74) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL2462807 0.73 NPC1 (1.00) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL3266359 0.72 CASP3 (0.72) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL3266017 0.72 CASP3 (0.72) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL3261588 0.72 CASP3 (1.00) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL3265418 0.72 CASP3 (0.72) RAB9ANPC1HSD17B10SMN1; SMN2TP53
SCHEMBL5660084 0.72 RAB9A (0.56) RAB9ANPC1HSD17B10SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10827753-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2020-11-10 US disclosed
US-20190343120-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2019-11-14 US disclosed
US-20190327967-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2019-10-31 US disclosed
US-10375958-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2019-08-13 US disclosed
US-20190021325-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2019-01-24 US disclosed
US-10112930-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2018-10-30 US disclosed
US-20170367338-A1 COMPOSITIONS AND METHODS FOR IMPROVING AGRONOMIC CHARACTERISTICS OF PLANTS MONSANTO TECHNOLOGY LLC (US) 2017-12-28 US disclosed
EP-2947080-B1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2017-10-25 EP disclosed
EP-3233080-A1 COMPOSITIONS AND METHODS FOR IMPROVING AGRONOMIC CHARACTERISTICS OF PLANTS Monsanto Technology LLC (US) 2017-10-25 EP disclosed
US-20170152247-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2017-06-01 US disclosed
EP-2786994-A1 Compositions and methods for controlling nematodes Monsanto Technology LLC (US) 2014-10-08 EP disclosed
EP-2786993-A1 Compositions and methods for controlling nematodes Monsanto Technology LLC (US) 2014-10-08 EP disclosed
EP-2786992-A1 Compositions and methods for controlling nematodes Monsanto Technology LLC (US) 2014-10-08 EP disclosed
CN-104059058-A Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC 2014-09-24 CN disclosed
CN-104054719-A Compositions And Methods For Controlling Nematodes MONSANTO TECHNOLOGY LLC 2014-09-24 CN disclosed
US-20130296166-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. 2013-11-07 US disclosed
US-8435999-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2013-05-07 US disclosed
EP-2184989-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES Divergence, Inc. (US) 2010-05-19 EP disclosed
WO-2009023721-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. (US) 2009-02-19 WO disclosed
US-20090048311-A1 Compostions and Methods for Controlling Nematodes MONSANTO TECHNOLOGY LLC 2009-02-19 US 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 (10 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-20170152247-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885
US-10112930-B2 Compositions and methods for controlling nematodes NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885
US-10827753-B2 Compositions and methods for controlling nematodes NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885
US-20190021325-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885
US-20130296166-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES ATL3, NOP2, PTMS RAB9A 3486/4885NPC1 3394/4885HSD17B10 2406/4885
US-20190343120-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885
US-20170367338-A1 COMPOSITIONS AND METHODS FOR IMPROVING AGRONOMIC CHARACTERISTICS OF PLANTS CYP51A1, MT-CO3, ACOX3 RAB9A 3594/4885NPC1 3561/4885HSD17B10 581/4885
US-20090048311-A1 Compostions and Methods for Controlling Nematodes NOP2, MT-CO3, CLPX RAB9A 4578/4885NPC1 4073/4885HSD17B10 2509/4885
US-10375958-B2 Compositions and methods for controlling nematodes NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885
US-20190327967-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS RAB9A 3412/4885NPC1 2871/4885HSD17B10 2408/4885

“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.