Sugi Predict

Sugi Predict / Compounds / SCHEMBL4971802

SCHEMBL4971802

SCHEMBL4971802

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PLA2G7 Q13093 1/20 0.35
▸ MGLL Q99685 1/20 0.35
▸ ABHD6 Q9BV23 1/20 0.35
▸ CYP3A4 P08684 2/20 0.34
▸ POLQ O75417 1/20 0.34
▸ TLR8 Q9NR97 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ NAMPT P43490 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PLOD2 O00469 1/20 0.33
▸ PLOD3 O60568 1/20 0.33
▸ PLOD1 Q02809 1/20 0.33
▸ GPBAR1 Q8TDU6 1/20 0.32
▸ GRM1 Q13255 1/20 0.32
▸ MLYCD O95822 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ USP2 O75604 1/20 0.32

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
SCHEMBL15363494 0.89 DGAT1 (0.40) DGAT1NPC1RAB9APLA2G7MGLL
SCHEMBL15363490 0.88 NPC1 (0.38) DGAT1NPC1RAB9APLA2G7MGLL
SCHEMBL14904618 0.87 NPC1 (0.40) DGAT1NPC1RAB9ATLR8NAMPT
SCHEMBL15363422 0.84 DGAT1 (0.40) DGAT1NPC1RAB9ACYP3A4POLQ
SCHEMBL4967348 0.83 NPC1 (0.38) DGAT1NPC1RAB9ATLR8ALDH1A1
SCHEMBL15975622 0.83 DGAT1 (0.41) DGAT1NPC1RAB9ACYP3A4POLQ
SCHEMBL15356728 0.82 DGAT1 (0.39) DGAT1NPC1RAB9APOLQALDH1A1
SCHEMBL16653197 0.81 NPC1 (0.41) DGAT1NPC1RAB9ATLR8ALDH1A1
SCHEMBL15363475 0.81 DGAT1 (0.38) DGAT1NPC1RAB9ACYP3A4TLR8
SCHEMBL18622368 0.81 DGAT1 (0.38) DGAT1NPC1RAB9ACYP3A4TLR8

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 24 patents — showing the first 20. 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-20160318924-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2016-11-03 — — 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-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
US-20130291227-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 — — US disclosed
US-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 — — US disclosed
WO-2013062981-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 — — WO disclosed
WO-2012061290-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 — — WO disclosed
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto CORTEVA AGRISCIENCE LLC 2012-05-03 — — 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-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS DGAT1 1025/4885NPC1 3920/4885RAB9A 980/4885
US-20160318924-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS DGAT1 1025/4885NPC1 3920/4885RAB9A 980/4885
US-20130291227-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS DGAT1 1025/4885NPC1 3920/4885RAB9A 980/4885
US-10165775-B2 Pesticidal compositions and processes related thereto ACHE, DDT, PTMS DGAT1 1025/4885NPC1 3920/4885RAB9A 980/4885
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto ACHE, DDT, PTMS DGAT1 1025/4885NPC1 3920/4885RAB9A 980/4885

“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.