SCHEMBL16653229

SCHEMBL16653229

O=C1NCCC1CCC(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.34
PGR P06401 2/20 0.33
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
CDC7 O00311 1/20 0.32
CDK9 P50750 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
SCHEMBL8370882 0.81 KDM4E (0.34) ARPGR
SCHEMBL21164841 0.81 PLG (0.35) AR
SCHEMBL30497353 0.80 AR (0.34) ARPGR
SCHEMBL30497365 0.80 AR (0.34) ARPGR
SCHEMBL2035767 0.79
SCHEMBL21256353 0.74 DAO (0.35)
SCHEMBL21244434 0.74 CCR2 (0.33)
SCHEMBL2997778 0.74
SCHEMBL8376974 0.74
SCHEMBL2485204 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105828610-B Pesticidal compositions and methods related thereto 美国陶氏益农公司 2019-07-19 CN disclosed
US-9523100-B2 Pesticidal compositions and related methods DOW AGROSCIENCES LLC (US) 2016-12-20 US disclosed
EP-3071036-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS Dow AgroSciences LLC (US) 2016-09-28 EP disclosed
US-20160208281-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC 2016-07-21 US disclosed
US-9295260-B2 Pesticidal compositions and related methods DOW AGROSCIENCES LLC (US) 2016-03-29 US disclosed
WO-2015061165-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2015-04-30 WO disclosed
US-20150111734-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC 2015-04-23 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-20160208281-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS ACHE, RDX, PRDX1 AR 3891/4885PGR 4626/4885PSEN1 3714/4885
US-20150111734-A1 PESTICIDAL COMPOSITIONS AND RELATED METHODS ACHE, RDX, CHRM2 AR 3428/4885PGR 4468/4885PSEN1 4140/4885

“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.