SCHEMBL3250285

SCHEMBL3250285

CC(C)CC(C)c1ccccc1NC(=O)c1scnc1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.37
KMT2A Q03164 4/20 0.37
USP2 O75604 1/20 0.37
PKM P14618 1/20 0.36
ANPEP P15144 1/20 0.36
MAPT P10636 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
FLT1 P17948 1/20 0.35
KDR P35968 1/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL28465404 0.81 USP2 (0.39) SMN1; SMN2KMT2AUSP2PKMANPEP
SCHEMBL13304854 0.78 KMT2A (0.65) SMN1; SMN2KMT2APKMMAPTALDH1A1
SCHEMBL1449903 0.75 RAB9A (0.55) SMN1; SMN2KMT2AMAPTALDH1A1NPC1
SCHEMBL4831743 0.75 HPGD (0.59) KMT2AANPEPMAPTALDH1A1KDM4E
SCHEMBL3258073 0.74 RAB9A (0.42) SMN1; SMN2KMT2APKMMAPTALDH1A1
SCHEMBL13304549 0.74 ATM (0.46) SMN1; SMN2GAA
SCHEMBL1987585 0.72 TSHR (0.49) SMN1; SMN2PKMANPEPALDH1A1RAB9A
SCHEMBL3238136 0.72 LMNA (0.40) KMT2APKMMAPTALDH1A1KDM4E
SCHEMBL13304628 0.72 NAMPT (0.44) KMT2APKMMAPTALDH1A1KDM4E
SCHEMBL7786621 0.72 RAB9A (0.40) SMN1; SMN2KMT2APKMMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2192115-A1 1,3-dimethylbutylcarboxanilides for controlling undesirable micro-organisms Bayer CropScience AG (DE) 2010-06-02 EP disclosed
EP-2192115-A1 1,3-dimethylbutylcarboxanilides for controlling undesirable micro-organisms Bayer CropScience AG (DE) 2010-06-02 EP disclosed
US-20070196406-A1 1,3-Dimethylbutyl carboxanilides for controlling undesirable micro-organisms BAYER CROPSCIENCE AG (DE) 2007-08-23 US disclosed
US-20070196406-A1 1,3-Dimethylbutyl carboxanilides for controlling undesirable micro-organisms BAYER CROPSCIENCE AG (DE) 2007-08-23 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 (1 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-20070196406-A1 1,3-Dimethylbutyl carboxanilides for controlling undesirable micro-organisms MCRS1, MRM1, PADI1 SMN1; SMN2 3729/4885KMT2A 1139/4885USP2 942/4885

“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.