Cyclopropane

Cyclopropane

SCHEMBL3772995

C1CC1.CC(C)c1ccccc1N

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.44
GABRB2 P47870 2/20 0.44
CYP3A4 P08684 3/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 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
SCHEMBL30223644 0.93 GABRA1 (0.50) GABRA1GABRB2CYP3A4ALOX15CASP1
SCHEMBL104513 0.93 GABRA1 (0.50) GABRA1GABRB2CYP3A4ALOX15CASP1
Hydrochloric Acid SCHEMBL2864375 0.90 GABRA1 (0.48) GABRA1GABRB2CYP3A4ALOX15CASP1
Bromide SCHEMBL7344099 0.90 GABRA1 (0.48) GABRA1GABRB2CYP3A4ALOX15CASP1
Dimethylamine SCHEMBL11252429 0.86 GABRA1 (0.44) GABRA1GABRB2CYP3A4ALOX15CASP1
Aniline SCHEMBL22169125 0.84 TSHR (0.50) GABRA1GABRB2CYP3A4ALOX15CASP1
SCHEMBL9818622 0.84 CYP3A4 (0.44) GABRA1GABRB2CYP3A4ALOX15CASP1
SCHEMBL6201553 0.82 CYP3A4 (0.48) GABRA1GABRB2CYP3A4ALOX15CASP1
SCHEMBL1061130 0.82 CYP3A4 (0.48) GABRA1GABRB2CYP3A4ALOX15CASP1
SCHEMBL16512108 0.82 CYP3A4 (0.48) GABRA1GABRB2CYP3A4ALOX15CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7847108-B2 such as N-[2-(4-bromophenyl)phenyl]-6-trifluoromethyl-2,3-dihydro-1,4-oxathiine-5-carboxamide, used for controlling unwanted microorganisms, for example, bacteria, fungi, yeasts, algae and slime organisms BAYER CROPSCIENCE AG (DE) 2010-12-07 US disclosed
US-20070004793-A1 such as N-[2-(4-bromophenyl)phenyl]-6-trifluoromethyl-2,3-dihydro-1,4-oxathiine-5-carboxamide, used for controlling unwanted microorganisms, for example, bacteria, fungi, yeasts, algae and slime organisms BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-01-04 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-20070004793-A1 such as N-[2-(4-bromophenyl)phenyl]-6-trifluoromethyl-2,3-dihydro-1,4-oxathiine-5-carboxamide, used for controlling unwanted microorganisms, for example, bacteria, fungi, yeasts, algae and slime organisms Q6ZSR9, PFAS, NIT2 GABRA1 4125/4885GABRB2 4255/4885CYP3A4 2846/4885

“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.