SCHEMBL9608084

SCHEMBL9608084

CCOC(=O)c1cnc(C#CCCNc2ncnc3ccccc23)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.48
LMNA P02545 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
LDHA P00338 1/20 0.44
AURKA O14965 3/20 0.44
AURKB Q96GD4 1/20 0.44
S1PR2 O95136 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KMT2A Q03164 5/20 0.42
MEN1 O00255 2/20 0.42
PKM P14618 1/20 0.42
GAA P10253 3/20 0.42
NPC1 O15118 2/20 0.41
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
ALPG P10696 1/20 0.41

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
SCHEMBL8504435 0.84 RAB9A (0.48) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL8504451 0.82 RAB9A (0.52) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL9608030 0.82 RAB9A (0.61) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL12960949 0.78 LDHA (0.47) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL9608077 0.73 LDHA (0.50) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL9608022 0.72 SMN1; SMN2 (0.54) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL8496823 0.72 SMN1; SMN2 (0.53) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL9609190 0.72 RAB9A (0.51) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL9608014 0.72 LDHA (0.53) RAB9ALMNASMN1; SMN2MAPTPOLB
SCHEMBL8505921 0.72 LDHA (0.48) RAB9ALMNASMN1; SMN2MAPTLDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9089139-B2 Agri-horticultural pest control compositions comprising 4-(3-butynyl)aminopyrimidine derivatives SDS BIOTECH K. K. (JP) 2015-07-28 US disclosed
US-9089139-B2 Agri-horticultural pest control compositions comprising 4-(3-butynyl)aminopyrimidine derivatives SDS BIOTECH K. K. (JP) 2015-07-28 US disclosed
US-8586505-B2 4-(3-butynyl)aminopyrimidine derivatives as pest control agents for agricultural and horticultural use SDS BIOTECH K. K. (JP) 2013-11-19 US disclosed
US-20130296271-A1 Agri-Horticultural Pest Control Compositions Comprising 4-(3-Butynyl)Aminopyrimidine Derivatives SDS BIOTECH K.K. (JP) 2013-11-07 US disclosed
US-20130296271-A1 Agri-Horticultural Pest Control Compositions Comprising 4-(3-Butynyl)Aminopyrimidine Derivatives SDS BIOTECH K.K. (JP) 2013-11-07 US disclosed
US-20120136150-A1 4-(3-Butynyl)Aminopyrimidine Derivatives as Pest Control Agents for Agricultural and Horticultural Use SDS BIOTECH K.K. (JP) 2012-05-31 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-20130296271-A1 Agri-Horticultural Pest Control Compositions Comprising 4-(3-Butynyl)Aminopyrimidine Derivatives HCN1, HCN2, HCN3 RAB9A 3469/4885LMNA 3472/4885SMN1; SMN2 3889/4885
US-20120136150-A1 4-(3-Butynyl)Aminopyrimidine Derivatives as Pest Control Agents for Agricultural and Horticultural Use CBR3, CBR1, HRH2 RAB9A 4200/4885LMNA 4659/4885SMN1; SMN2 4679/4885

“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.