SCHEMBL6661618

SCHEMBL6661618

NC(CCl)Cc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.73
ANPEP P15144 2/20 0.61
SLC6A2 P23975 2/20 0.54
TAAR1 Q96RJ0 2/20 0.54
SLC6A4 P31645 2/20 0.54
MAOA P21397 1/20 0.54
SLC6A3 Q01959 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
CYP2A6 P11509 1/20 0.54
ADORA2A P29274 1/20 0.54
ADORA1 P30542 1/20 0.54
CYP2D6 P10635 1/20 0.50
ALPI P09923 1/20 0.48
PKM P14618 1/20 0.48
PTGS1 P23219 1/20 0.48
XIAP P98170 1/20 0.48
SLC7A5 Q01650 1/20 0.48
SCN4A P35499 2/20 0.46
MMP2 P08253 1/20 0.46
LAP3 P28838 2/20 0.45

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
SCHEMBL4221251 1.00 EPHX1 (0.73) EPHX1ANPEPSLC6A2TAAR1SLC6A4
Hydrochloric Acid SCHEMBL7118835 0.98 EPHX1 (0.70) EPHX1ANPEPSLC6A2TAAR1SLC6A4
Hydrochloric Acid SCHEMBL30341546 0.98 EPHX1 (0.70) EPHX1ANPEPSLC6A2TAAR1SLC6A4
Hydrochloric Acid SCHEMBL7118839 0.98 EPHX1 (0.70) EPHX1ANPEPSLC6A2TAAR1SLC6A4
SCHEMBL28656 0.85 EPHX1 (1.00) EPHX1ANPEPSLC6A2TAAR1SLC6A4
Hydrochloric Acid SCHEMBL9402300 0.82 EPHX1 (0.94) EPHX1ANPEPSLC6A2TAAR1SLC6A4
SCHEMBL15638343 0.82 EPHX1 (0.67) EPHX1ANPEPSLC6A2TAAR1SLC6A4
SCHEMBL18034347 0.80 EPHX1 (0.80) EPHX1ANPEPSLC6A2TAAR1SLC6A4
SCHEMBL2736189 0.80 EPHX1 (0.80) EPHX1ANPEPSLC6A2TAAR1SLC6A4
SCHEMBL902607 0.80 EPHX1 (0.80) EPHX1ANPEPSLC6A2TAAR1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12565489-B2 Heterocyclyl pyrimidines and triazines as novel fungicides BAYER AKTIENGESELLSCHAFT (DE) 2026-03-03 US disclosed
US-12534456-B2 Heterocyclyl pyridines as novel fungicides BAYER AKTIENGESELLSCHAFT (DE) 2026-01-27 US disclosed
US-20230295138-A1 HETEROCYCLYL PYRIDINES AS NOVEL FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 2023-09-21 US disclosed
US-20230278994-A1 HETEROCYCLYL PYRIMIDINES AND TRIAZINES AS NOVEL FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 2023-09-07 US disclosed
CN-116157397-A Heterocyclylpyridines as novel fungicides 拜耳公司 2023-05-23 CN disclosed
EP-4161914-A1 HETEROCYCLYL PYRIDINES AS NOVEL FUNGICIDES Bayer Aktiengesellschaft (DE) 2023-04-12 EP disclosed
EP-4161906-A1 HETEROCYCLYL PYRIMIDINES AND TRIAZINES AS NOVEL FUNGICIDES Bayer Aktiengesellschaft (DE) 2023-04-12 EP disclosed
CN-110869349-A 2- { [2- (phenoxymethyl) pyridin-5-yl ] oxy } ethanamine derivatives and related compounds as pest control agents, e.g. for protecting plants 拜耳作物科学股份公司 2020-03-06 CN disclosed
WO-2014197090-A2 PRESERVATION OF BIOLOGICAL MATERIALS IN NON-AQUEOUS FLUID MEDIA GENTEGRA, LLC (US) 2014-12-11 WO disclosed
EP-1442006-A2 PREPARATION OF AMPHETAMINES FROM PHENYLPROPANOLAMINES Boehringer Ingelheim Chemicals, Inc. (US) 2004-08-04 EP disclosed
WO-2003037843-A2 PREPARATION OF AMPHETAMINES FROM PHENYLPROPANOLAMINES BOEHRINGER INGELHEIM CHEMICALS, INC. (US) 2003-05-08 WO disclosed
CN-1337955-A Substituted 2-arylimino heterocycles and compositions containing them, for use as progesterone receptor binding agents AMERICAN BAYER CORP (US) 2002-02-27 CN 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-12565489-B2 Heterocyclyl pyrimidines and triazines as novel fungicides CBR1, CBR3, NOX1 EPHX1 1322/4885ANPEP 3399/4885SLC6A2 3147/4885
US-20230278994-A1 HETEROCYCLYL PYRIMIDINES AND TRIAZINES AS NOVEL FUNGICIDES DPYD, DPM1, DHPS EPHX1 785/4885ANPEP 1417/4885SLC6A2 4403/4885
US-20230295138-A1 HETEROCYCLYL PYRIDINES AS NOVEL FUNGICIDES PNPO, CBR3, HPD EPHX1 541/4885ANPEP 1419/4885SLC6A2 4665/4885
US-12534456-B2 Heterocyclyl pyridines as novel fungicides CBR1, CBR3, NOX1 EPHX1 1291/4885ANPEP 2960/4885SLC6A2 3327/4885

“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.