SCHEMBL15910364

SCHEMBL15910364

Cc1nn(-c2cccnc2)cc1N(C)C(=O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 4/20 0.38
TSHR P16473 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.37
CYP2A6 P11509 3/20 0.36
CYP2E1 P05181 2/20 0.36
MAP3K5 Q99683 1/20 0.36
GAA P10253 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
TLR8 Q9NR97 1/20 0.35
LMNA P02545 1/20 0.35
NAMPT P43490 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
CACNA2D1 P54289 1/20 0.34
RIPK2 O43353 1/20 0.34

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 0.88 MAPK1 (0.36) GRM1TSHRNPC1RAB9AMAPK1
SCHEMBL4967929 0.88 MAPK1 (0.36) GRM1NPC1RAB9AMAPK1CYP2A6
SCHEMBL4970613 0.86 GRM1 (0.35) GRM1TSHRNPC1RAB9AMAPK1
SCHEMBL14904691 0.86 NPC1 (0.36) GRM1TSHRNPC1RAB9AMAPK1
SCHEMBL14904611 0.86 NPC1 (0.40) GRM1TSHRNPC1RAB9AMAPK1
SCHEMBL15363463 0.86 MAP3K5 (0.31) MAP3K5
SCHEMBL2733010 0.86 NPC1 (0.42) GRM1TSHRNPC1RAB9AMAPK1
SCHEMBL14904639 0.85 DGAT1 (0.44) GRM1NPC1RAB9AMAPK1GAA
SCHEMBL15356729 0.84 CYP3A4 (0.39) NPC1RAB9AMAPK1MAP3K5CYP3A4
SCHEMBL15363419 0.84 DGAT1 (0.37) GRM1NPC1RAB9AMAPK1MAP3K5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-20140213448-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-07-31 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 (2 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-20140213448-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS GRM1 2514/4885TSHR 1156/4885NPC1 3920/4885
US-10165775-B2 Pesticidal compositions and processes related thereto ACHE, DDT, PTMS GRM1 2514/4885TSHR 1156/4885NPC1 3920/4885

“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.