SCHEMBL15975693

SCHEMBL15975693

CSC(C)C(=O)N(C)c1cn(-c2cccnc2)nc1Br

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
GRM1 Q13255 2/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAP3K5 Q99683 1/20 0.32
CYP2A6 P11509 1/20 0.32
ALDH1A1 P00352 3/20 0.31
HTT P42858 1/20 0.31
DGAT1 O75907 1/20 0.31
GRM5 P41594 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
RECQL P46063 1/20 0.31
TLR8 Q9NR97 1/20 0.31
PRMT5 O14744 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL15363511 0.89 MAPK1 (0.36) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL15363512 0.87 LMNA (0.35) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL29901222 0.87 LMNA (0.34) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL15356835 0.87 LMNA (0.34) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL15363522 0.86 NPC1 (0.35) LMNAMAPK1NPC1RAB9AMAP3K5
SCHEMBL18627132 0.84 NPC1 (0.35) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL15363535 0.84 LMNA (0.34) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL15356713 0.84 NPC1 (0.35) LMNAMAPK1GRM1NPC1RAB9A
SCHEMBL2690794 0.83 MAPK1 (0.40) MAPK1GRM1NPC1RAB9ACYP2A6
SCHEMBL14904646 0.81 ALDH1A1 (0.37) MAPK1NPC1RAB9ACYP2A6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200055846-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2020-02-20 US disclosed
US-10165775-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2019-01-01 US disclosed
US-9708288-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-07-18 US disclosed
US-9708288-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-07-18 US disclosed
US-9655365-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-05-23 US disclosed
US-9655365-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-05-23 US disclosed
US-9591857-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-03-14 US disclosed
US-9591857-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-03-14 US disclosed
US-9422278-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2016-08-23 US disclosed
US-9422278-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2016-08-23 US disclosed
US-9282739-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2016-03-15 US disclosed
US-20150335022-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2015-11-26 US disclosed
US-8937083-B2 Pesticidal compositions and processes related thereto DowAgroSciences, LLC (US) 2015-01-20 US disclosed
US-8937083-B2 Pesticidal compositions and processes related thereto DowAgroSciences, LLC (US) 2015-01-20 US disclosed
US-8901153-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-12-02 US disclosed
US-8901153-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-12-02 US disclosed
US-8815271-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-08-26 US disclosed
US-8815271-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-08-26 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 (3 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-20150335022-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS LMNA 2810/4885MAPK1 2599/4885GRM1 2514/4885
US-20200055846-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS LMNA 2810/4885MAPK1 2599/4885GRM1 2514/4885
US-10165775-B2 Pesticidal compositions and processes related thereto ACHE, DDT, PTMS LMNA 2810/4885MAPK1 2599/4885GRM1 2514/4885

“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.