SCHEMBL15637243

SCHEMBL15637243

Nc1cnn(-c2ccccc2Br)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MGLL Q99685 1/20 0.36
MAPT P10636 5/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPK1 P28482 1/20 0.35
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
HPGD P15428 2/20 0.33
ALOX15 P16050 2/20 0.33
CASP1 P29466 2/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
BACE1 P56817 2/20 0.32
HTR1A P08908 1/20 0.32
APAF1 O14727 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
SCHEMBL29572130 1.00 NPC1 (0.42) NPC1RAB9AMGLLMAPTALDH1A1
SCHEMBL29571825 0.78 ADORA2A (0.43) MGLLMAPTALDH1A1KDM4EMEN1
SCHEMBL28534253 0.78 POLB (0.40) NPC1RAB9AMAPTALDH1A1MAPK1
SCHEMBL15637454 0.78 ADORA2A (0.43) MGLLMAPTALDH1A1KDM4EMEN1
SCHEMBL11785056 0.76 ALDH1A1 (0.54) NPC1RAB9AMAPTALDH1A1MAPK1
SCHEMBL15639322 0.74 MEN1 (0.33) NPC1RAB9AMAPTALDH1A1KDM4E
SCHEMBL18039129 0.72 P2RX7 (0.53) NPC1RAB9AMAPTALDH1A1MAPK1
SCHEMBL15639943 0.69 NPC1 (0.38) NPC1RAB9AMGLLMAPTALDH1A1
SCHEMBL29572211 0.69 NPC1 (0.38) NPC1RAB9AMGLLMAPTALDH1A1
SCHEMBL15639447 0.68 MGLL (0.37) NPC1RAB9AMGLLMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548854-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2023-01-10 US disclosed
US-11332448-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2022-05-17 US disclosed
CN-113243374-B Heterocyclic compounds as pesticides 拜耳农作物科学股份公司 2022-04-26 CN disclosed
CN-113243374-A Heterocyclic compounds as pesticides 拜耳农作物科学股份公司 2021-08-13 CN disclosed
CN-108477173-B Heterocyclic compounds as pesticides 拜耳农作物科学股份公司 2021-07-02 CN disclosed
US-10961201-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2021-03-30 US disclosed
US-20210053924-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-02-25 US disclosed
US-20210017136-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-01-21 US disclosed
US-10689348-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2020-06-23 US disclosed
US-10435374-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2019-10-08 US disclosed
CN-108477173-A Heterocyclic compound as insecticide 拜耳农作物科学股份公司 2018-09-04 CN disclosed
CN-105101800-B Heterocyclic Compounds as Pesticides 拜耳农作物科学股份公司 2018-04-13 CN disclosed
US-9802899-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2017-10-31 US disclosed
US-20170305864-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2017-10-26 US disclosed
EP-2903440-B1 HETEROCYCLIC COMPOUNDS AS PEST CONTROLLING AGENTS BAYER CROPSCIENCE AG (DE) 2017-09-06 EP disclosed
CN-105101800-A Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG 2015-11-25 CN disclosed
US-20150239847-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2015-08-27 US disclosed
EP-2903440-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES Bayer CropScience AG (DE) 2015-08-12 EP disclosed
WO-2014053450-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2014-04-10 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 (9 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-10435374-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-20170305864-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-10961201-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-10689348-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-11548854-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-20210053924-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-11332448-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-20210017136-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885
US-20150239847-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES DDT, ACHE, PTMS NPC1 3509/4885RAB9A 1244/4885MGLL 1199/4885

“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.