SCHEMBL16319264

SCHEMBL16319264

CNC(=O)C(=NOC)C(C)=CCOc1ccn(-c2ccc(C)c(C)c2)n1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
ALDH1A1 P00352 2/20 0.35
SIGMAR1 Q99720 5/20 0.33
KCNH2 Q12809 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
MIF P14174 1/20 0.31
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
TP53 P04637 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
SCHEMBL16319263 1.00 NPC1 (0.35) NPC1ALDH1A1SIGMAR1KCNH2CYP1A2
SCHEMBL16319262 1.00 NPC1 (0.35) NPC1ALDH1A1SIGMAR1KCNH2CYP1A2
SCHEMBL16318795 0.92 GRIN2B (0.33) SIGMAR1KCNH2CYP1A2CYP2C19
SCHEMBL16318793 0.92 GRIN2B (0.33) SIGMAR1KCNH2CYP1A2CYP2C19
SCHEMBL16318791 0.92 GRIN2B (0.33) SIGMAR1KCNH2CYP1A2CYP2C19
SCHEMBL16318914 0.90 ALDH1A1 (0.39) NPC1ALDH1A1SIGMAR1KCNH2RAB9A
SCHEMBL16318916 0.90 ALDH1A1 (0.39) NPC1ALDH1A1SIGMAR1KCNH2RAB9A
SCHEMBL16318917 0.90 ALDH1A1 (0.39) NPC1ALDH1A1SIGMAR1KCNH2RAB9A
SCHEMBL16319188 0.88 SIGMAR1 (0.46) SIGMAR1KCNH2
SCHEMBL16319191 0.88 SIGMAR1 (0.46) SIGMAR1KCNH2

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190098899-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2019-04-04 US claimed
US-20180235221-A1 FUNGICIDAL MIXTURES COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2018-08-23 US claimed
EP-3267797-A1 FUNGICIDAL MIXTURES COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2018-01-17 EP claimed
EP-3010344-B1 FUNGICIDAL MIXTURES I COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2017-11-15 EP claimed
US-9763448-B2 Fungicidal mixtures I comprising strobilurin-type fungicides BASF SE (DE) 2017-09-19 US claimed
WO-2016142224-A1 FUNGICIDAL MIXTURES COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2016-09-15 WO claimed
EP-2815650-B1 Fungicidal mixtures II comprising strobilurin-type fungicides BASF SE (DE) 2016-08-17 EP claimed
US-20160135459-A1 FUNGICIDAL MIXTURES I COMPRISING STROBILURIN-TYPE FUNGICIDES BASF Agro B.V. (NL) 2016-05-19 US claimed
EP-3010344-A1 FUNGICIDAL MIXTURES I COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2016-04-27 EP claimed
EP-2835052-A1 Fungicidal mixtures comprising pyrimidine fungicides BASF SE (DE) 2015-02-11 EP claimed
WO-2014202421-A1 FUNGICIDAL MIXTURES I COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2014-12-24 WO claimed
EP-2815650-A1 Fungicidal mixtures II comprising strobilurin-type fungicides BASF SE (DE) 2014-12-24 EP claimed
EP-2815649-A1 Fungicidal mixtures II comprising strobilurin-type fungicides BASF SE (DE) 2014-12-24 EP claimed
US-20190098899-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2019-04-04 US disclosed
US-20180235221-A1 FUNGICIDAL MIXTURES COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2018-08-23 US disclosed
EP-3267797-A1 FUNGICIDAL MIXTURES COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2018-01-17 EP disclosed
EP-2835052-A1 Fungicidal mixtures comprising pyrimidine fungicides BASF SE (DE) 2015-02-11 EP disclosed
EP-2815649-A1 Fungicidal mixtures II comprising strobilurin-type fungicides BASF SE (DE) 2014-12-24 EP disclosed
WO-2014202421-A1 FUNGICIDAL MIXTURES I COMPRISING STROBILURIN-TYPE FUNGICIDES BASF SE (DE) 2014-12-24 WO disclosed
EP-2815650-A1 Fungicidal mixtures II comprising strobilurin-type fungicides BASF SE (DE) 2014-12-24 EP 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-20180235221-A1 FUNGICIDAL MIXTURES COMPRISING STROBILURIN-TYPE FUNGICIDES DDT, STS, SNX1 NPC1 1991/4885ALDH1A1 622/4885SIGMAR1 3797/4885
US-20160135459-A1 FUNGICIDAL MIXTURES I COMPRISING STROBILURIN-TYPE FUNGICIDES STS, SNX1, SFXN1 NPC1 1828/4885ALDH1A1 865/4885SIGMAR1 3281/4885
US-20190098899-A1 FUNGICIDAL MIXTURES III COMPRISING STROBILURIN-TYPE FUNGICIDES DDT, SNX3, SFXN3 NPC1 2368/4885ALDH1A1 1035/4885SIGMAR1 3647/4885

“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.