SCHEMBL3266017

SCHEMBL3266017

Ic1ccc(-c2noc(-c3ccco3)n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.72
RAB9A P51151 13/20 0.69
NPC1 O15118 12/20 0.69
SMN1; SMN2 Q16637 8/20 0.69
TSHR P16473 3/20 0.69
ALDH1A1 P00352 4/20 0.60
TP53 P04637 4/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPK1 P28482 2/20 0.59
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
MAPT P10636 7/20 0.55
HSD17B10 Q99714 6/20 0.54
POLB P06746 1/20 0.54
PKM P14618 1/20 0.54
KDM4E B2RXH2 5/20 0.47
HPGD P15428 4/20 0.47
USP2 O75604 3/20 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
SCHEMBL13930818 0.85 CASP3 (0.74) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13930846 0.85 NPC1 (0.76) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL3265418 0.84 CASP3 (0.72) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL3266359 0.84 CASP3 (0.72) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL3261588 0.84 CASP3 (1.00) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL2458259 0.82 NPC1 (1.00) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL12171145 0.80 CASP3 (0.67) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL11715629 0.76 CASP3 (0.60) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL2462807 0.75 NPC1 (1.00) CASP3RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL414494 0.74 TAAR1 (0.61) RAB9ANPC1TSHRALDH1A1MEN1

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 60 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-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-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-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-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-20190021325-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2019-01-24 US 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
US-8435999-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2013-05-07 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
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
US-20090048311-A1 Compostions and Methods for Controlling Nematodes MONSANTO TECHNOLOGY LLC 2009-02-19 US 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 (7 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-10827753-B2 Compositions and methods for controlling nematodes NOP2, ATL3, CYCS CASP3 477/4885RAB9A 3412/4885NPC1 2871/4885
US-20190021325-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS CASP3 477/4885RAB9A 3412/4885NPC1 2871/4885
US-20130296166-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES ATL3, NOP2, PTMS CASP3 654/4885RAB9A 3486/4885NPC1 3394/4885
US-20190343120-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS CASP3 477/4885RAB9A 3412/4885NPC1 2871/4885
US-20090048311-A1 Compostions and Methods for Controlling Nematodes NOP2, MT-CO3, CLPX CASP3 634/4885RAB9A 4578/4885NPC1 4073/4885
US-10375958-B2 Compositions and methods for controlling nematodes NOP2, ATL3, CYCS CASP3 477/4885RAB9A 3412/4885NPC1 2871/4885
US-20190327967-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES NOP2, ATL3, CYCS CASP3 477/4885RAB9A 3412/4885NPC1 2871/4885

“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.