SCHEMBL302684

SCHEMBL302684

CCCCCCCCc1nc2ncnn2c(N)c1CC

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MBOAT4 Q96T53 18/20 0.42
ATM Q13315 1/20 0.39

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
SCHEMBL3869997 1.00 GAA (0.42) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3876315 0.92 GAA (0.42) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3868099 0.92 GAA (0.42) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3871870 0.92 GAA (0.42) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL4921904 0.92 GAA (0.45) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3122488 0.92 GAA (0.45) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3121971 0.89 GAA (0.45) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL174682 0.89 GAA (0.45) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3130141 0.89 GAA (0.45) GAAHTTSMN1; SMN2MBOAT4ATM
SCHEMBL3135629 0.89 GAA (0.45) GAAHTTSMN1; SMN2MBOAT4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2489262-B1 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2018-11-14 EP claimed
US-20150080215-A1 TERNARY PESTICIDAL MIXTURES BASF SE (DE) 2015-03-19 US claimed
EP-2066177-B1 FUNGICIDAL MIXTURES OF 1-METHYLPYRAZOLE-4-YLCARBOXYLIC ACID ANILIDES AND AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2014-12-24 EP claimed
US-20140179518-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds BASF SE (DE) 2014-06-26 US claimed
US-20140155263-A1 Fungicidal Mixtures Based on Azolopyrimidinylamines BASF SE (DE) 2014-06-05 US claimed
US-20130267414-A1 PESTICIDAL MIXTURES BASF SE (DE) 2013-10-10 US claimed
US-8461077-B2 Combinations of active substances BASF SE (DE) 2013-06-11 US claimed
US-20130137571-A1 Crystalline Modification of Fipronil BASF SE (DE) 2013-05-30 US claimed
EP-2552213-A2 FUNGICIDAL MIXTURES BASED ON AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2013-02-06 EP claimed
US-20130023412-A1 Fungicidal Mixtures Based on Azolopyrimidinylamines BASF SE (DE) 2013-01-24 US claimed
WO-2008092759-A2 PESTICIDAL MIXTURES BASED ON AZOLOPYRIMIDINYLAMINES DERIVATIVES AND INSECTICIDES BASF SE (DE) 2008-08-07 WO claimed
WO-2008092836-A2 METHOD FOR IMPROVING PLANT HEALTH BASF SE (DE) 2008-08-07 WO claimed
WO-2008087182-A2 FUNGICIDAL MIXTURES OF 1-METHYLPYRAZOLE-4-YLCARBOXYLIC ACID ANILIDES AND AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2008-07-24 WO claimed
EP-1909579-A1 FUNGICIDAL MIXTURES BASED ON AZOLOPYRIMIDINYLAMINES BASF SE (DE) 2008-04-16 EP claimed
WO-2008034787-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2008-03-27 WO claimed
WO-2008034785-A2 PESTICIDAL MIXTURES COMPRISING AN ANTHRANILAMIDE INSECTICIDE AND A FUNGICIDE BASF SE (DE) 2008-03-27 WO claimed
US-20070179061-A1 Aminotriazolopyrimidines, their preparation and their use for controlling harmful fungi, and compositions comprising these compounds BASF AKTIENGESELLSCHAFT (DE) 2007-08-02 US claimed
WO-2007012598-A1 FUNGICIDAL MIXTURES BASED ON AZOLOPYRIMIDINYLAMINES BASF AKTIENGESELLSCHAFT (DE) 2007-02-01 WO claimed
EP-1725559-A2 5,6-DIALKYL-7-AMINO-TRIAZOLOPYRIMIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE FOR CONTROLLING PATHOGENIC FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2006-11-29 EP claimed
WO-2005087771-A2 5,6-DIALKYL-7-AMINO-TRIAZOLOPYRIMIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE FOR CONTROLLING PATHOGENIC FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2005-09-22 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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-20130023412-A1 Fungicidal Mixtures Based on Azolopyrimidinylamines DDT, AS3MT, AADAC GAA 2639/4885HTT 2143/4885SMN1; SMN2 3534/4885
US-20130267414-A1 PESTICIDAL MIXTURES AADAC, CTRL, AAAS GAA 187/4885HTT 968/4885SMN1; SMN2 810/4885
US-20140155263-A1 Fungicidal Mixtures Based on Azolopyrimidinylamines DDT, STS, ARSA GAA 1285/4885HTT 3552/4885SMN1; SMN2 2007/4885
US-20070179061-A1 Aminotriazolopyrimidines, their preparation and their use for controlling harmful fungi, and compositions comprising these compounds DPM1, ERG28, AGPS GAA 1876/4885HTT 2705/4885SMN1; SMN2 4345/4885
US-20140179518-A1 Pesticidal Mixtures Comprising Cyanosulfoximine Compounds CPN1, SRM, STS GAA 615/4885HTT 1511/4885SMN1; SMN2 1517/4885
US-20130137571-A1 Crystalline Modification of Fipronil FIP1L1, PTMS, FIBP GAA 327/4885HTT 1671/4885SMN1; SMN2 4269/4885
US-20150080215-A1 TERNARY PESTICIDAL MIXTURES AADAC, AS3MT, DDT GAA 270/4885HTT 1859/4885SMN1; SMN2 899/4885

“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.