SCHEMBL7067663

SCHEMBL7067663

COC(=O)C(NC(=O)c1snc(Cl)c1Cl)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
TACR3 P29371 1/20 0.37
CNR2 P34972 4/20 0.37
CNR1 P21554 3/20 0.37
THRB P10828 1/20 0.36
CA12 O43570 1/20 0.36
CA14 Q9ULX7 1/20 0.36
MEN1 O00255 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 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
SCHEMBL8153291 0.87 ALDH1A1 (0.46) TAS1R3TAS1R1ALDH1A1CNR2CNR1
SCHEMBL7067885 0.85 EGLN1 (0.44) SMN1; SMN2NPSR1TSHR
SCHEMBL7067333 0.85 CHRM4 (0.36) ALDH1A1SMN1; SMN2CNR2CNR1CA14
SCHEMBL23560356 0.77 TAS1R3 (0.47) TAS1R3TAS1R1ALDH1A1SMN1; SMN2NPSR1
SCHEMBL25061792 0.77 TAS1R3 (0.47) TAS1R3TAS1R1ALDH1A1SMN1; SMN2NPSR1
SCHEMBL7067322 0.74 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13515520 0.74 CHRM4 (0.32)
SCHEMBL22262978 0.72 PYGL (0.53) ALDH1A1TACR3THRBCYP2C9CYP2C19
SCHEMBL22262980 0.72 PYGL (0.53) ALDH1A1TACR3THRBCYP2C9CYP2C19
SCHEMBL22263188 0.72 ALDH1A1 (0.32) ALDH1A1

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
US-6552056-B2 Bactericides; fungicides; miticides; nematocides; for agriculture NIHON BAYER AGROCHEM K.K. (JP) 2003-04-22 US disclosed
US-20030013750-A1 Isothiazolecarboxamides and their use as microbicides NIHOM BAYER AGROCHEM K.K. (JP) 2003-01-16 US disclosed
EP-1185519-A1 ISOTHIAZOLECARBOXAMIDES AND THEIR USE AS MICROBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2002-03-13 EP disclosed
WO-2000073290-A1 ISOTHIAZOLECARBOXAMIDES AND THEIR USE AS MICROBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2000-12-07 WO 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-20030013750-A1 Isothiazolecarboxamides and their use as microbicides MCL1, MSR1, MPO TAS1R3 12/4885TAS1R1 19/4885ALDH1A1 591/4885

“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.