SCHEMBL406517

SCHEMBL406517

Nc1ccnn1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.57
NPBWR1 P48145 1/20 0.38
MCHR1 Q99705 1/20 0.38
GRM5 P41594 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDR P35968 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
NR3C2 P08235 1/20 0.34
PTGS1 P23219 1/20 0.33

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
SCHEMBL544287 0.83 POLB (0.61) POLBNPBWR1MCHR1KDM4EMEN1
SCHEMBL1247688 0.82 POLB (0.64) POLBTP53KDM4EMEN1KMT2A
SCHEMBL9459015 0.78 KDR (0.51) POLBTP53CYP3A4KDM4ENPSR1
SCHEMBL1491128 0.77 POLB (0.53) POLBCYP3A4NPSR1
SCHEMBL15428758 0.76 POLB (0.57) POLBKDM4EMEN1KMT2ANPC1
SCHEMBL15428658 0.76 POLB (0.57) POLBNPBWR1MCHR1TP53CYP3A4
SCHEMBL406516 0.74 ALDH1A1 (0.41) NPBWR1MCHR1KDM4ENPSR1MEN1
SCHEMBL433371 0.72 POLB (1.00) POLBTP53CYP3A4KDM4ENPSR1
SCHEMBL1491136 0.72 POLB (0.69) POLBCYP3A4KDM4ENPSR1MEN1
SCHEMBL15428572 0.72 POLB (0.43) POLBTP53CYP3A4KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435068-B2 Anthelmintic compounds ELANCO ANIMAL HEALTH GMBH (DE) 2025-10-07 US disclosed
CN-119409690-A Novel insect repellent compound 拜耳动物保健有限责任公司 2025-02-11 CN disclosed
US-20210380566-A1 NEW ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2021-12-09 US disclosed
US-20210380566-A1 NEW ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2021-12-09 US disclosed
CN-113166123-A Novel insect repellent compounds 拜耳动物保健有限责任公司 2021-07-23 CN disclosed
EP-3847168-A2 NEW ANTHELMINTIC COMPOUNDS Bayer Animal Health GmbH (DE) 2021-07-14 EP disclosed
EP-3643711-A1 NEW ANTHELMINTIC COMPOUNDS Bayer Animal Health GmbH (DE) 2020-04-29 EP disclosed
EP-3643711-A1 NEW ANTHELMINTIC COMPOUNDS Bayer Animal Health GmbH (DE) 2020-04-29 EP disclosed
US-20160244456-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2016-08-25 US disclosed
EP-2962566-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS Genentech, Inc. (US) 2016-01-06 EP disclosed
EP-2348860-B1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH INC (US) 2015-05-27 EP disclosed
US-20140107099-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2014-04-17 US disclosed
US-8637526-B2 Pyrazolopyrimidine JAK inhibitor compounds and methods GENENTECH, INC. (US) 2014-01-28 US disclosed
US-20120022043-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2012-01-26 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 (5 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-20120022043-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 POLB 2697/4885NPBWR1 1932/4885MCHR1 1910/4885
US-20140107099-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 POLB 2697/4885NPBWR1 1932/4885MCHR1 1910/4885
US-20160244456-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 POLB 2697/4885NPBWR1 1932/4885MCHR1 1910/4885
US-12435068-B2 Anthelmintic compounds H1-10, HRH2, HRH1 POLB 4008/4885NPBWR1 1835/4885MCHR1 913/4885
US-20210380566-A1 NEW ANTHELMINTIC COMPOUNDS H1-10, HRH2, HRH4 POLB 3969/4885NPBWR1 1774/4885MCHR1 883/4885

“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.