SCHEMBL1219262

SCHEMBL1219262

Clc1ccc(-c2coc(-c3ccco3)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.62
HSD17B10 Q99714 6/20 0.62
MAPT P10636 6/20 0.62
ALDH1A1 P00352 5/20 0.62
HPGD P15428 5/20 0.62
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
TP53 P04637 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C19 P33261 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
CASP3 P42574 1/20 0.59
ESR1 P03372 1/20 0.49
LTA4H P09960 1/20 0.48
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
S1PR1 P21453 1/20 0.44
LMNA P02545 4/20 0.43
TSHR P16473 1/20 0.43
PIK3R1 P27986 1/20 0.43

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
SCHEMBL21631837 0.81 HSD17B10 (0.50) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL1217073 0.79 ALOX15 (0.57) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL5211157 0.78 ENPP3 (0.62) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL28474694 0.78 ENPP3 (0.62) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL13930787 0.77 KDM4E (1.00) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL1478175 0.74 TAAR1 (0.61) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL3261588 0.74 CASP3 (1.00) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL5000800 0.74 CASP3 (0.51) KDM4EHSD17B10MAPTALDH1A1HPGD
SCHEMBL28478085 0.73 HDAC1 (0.49) ALDH1A1NPC1RAB9ALTA4HS1PR1
SCHEMBL2095342 0.73 HSD17B1 (0.62) HSD17B10MAPTALDH1A1HPGDLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180070591-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US claimed
EP-2944636-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES USING COMPOUNDS WITH THREE RINGS, ONE OF THEM A PYRROLE Monsanto Technology LLC (US) 2015-11-18 EP claimed
US-20180070591-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US disclosed
US-20180070591-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US disclosed
US-20180070591-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2018-03-15 US disclosed
US-9820486-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2017-11-21 US disclosed
US-9820486-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2017-11-21 US disclosed
US-9820486-B2 Compositions and methods for controlling nematodes MONSANTO TECHNOLOGY LLC (US) 2017-11-21 US disclosed
US-20160262396-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2016-09-15 US disclosed
US-20160262396-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2016-09-15 US disclosed
US-20160262396-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES MONSANTO TECHNOLOGY LLC (US) 2016-09-15 US disclosed
US-8017555-B2 Compositions and methods for controlling nematodes DIVERGENCE, INC. (US) 2011-09-13 US disclosed
US-20110028320-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. 2011-02-03 US disclosed
US-20110028320-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. 2011-02-03 US disclosed
US-20110028320-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. 2011-02-03 US disclosed
US-20100210849-A1 Compositions and Methods for Controlling Nematodes DIVERGENCE, INC. (US) 2010-08-19 US disclosed
US-20100210849-A1 Compositions and Methods for Controlling Nematodes DIVERGENCE, INC. (US) 2010-08-19 US disclosed
US-20100210849-A1 Compositions and Methods for Controlling Nematodes DIVERGENCE, INC. (US) 2010-08-19 US disclosed
WO-2010093650-A2 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. (US) 2010-08-19 WO disclosed
WO-2010093650-A2 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES DIVERGENCE, INC. (US) 2010-08-19 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 (4 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-20180070591-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES ATL3, NOP2, PTMS KDM4E 1933/4885HSD17B10 2406/4885MAPT 2871/4885
US-20160262396-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES ATL3, NOP2, PTMS KDM4E 1933/4885HSD17B10 2406/4885MAPT 2871/4885
US-20100210849-A1 Compositions and Methods for Controlling Nematodes ATL3, NOP2, PTMS KDM4E 1933/4885HSD17B10 2406/4885MAPT 2871/4885
US-20110028320-A1 COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES ATL3, NOP2, PTMS KDM4E 1933/4885HSD17B10 2406/4885MAPT 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.