SCHEMBL91387

SCHEMBL91387

CCc1csc(NC(=O)c2ccc(C(C)(C)C)cc2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
TAS1R3 Q7RTX0 1/20 0.53
TAS1R1 Q7RTX1 1/20 0.53
TAS1R2 Q8TE23 1/20 0.53
KDM4E B2RXH2 4/20 0.52
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
PDE5A O76074 1/20 0.51
TYR P14679 1/20 0.50
MAP3K5 Q99683 1/20 0.48
HTT P42858 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47

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
SCHEMBL5659032 0.89 SCD (0.56) MAPTMEN1KMT2ASMN1; SMN2TAS1R3
SCHEMBL5659620 0.88 KMT2A (0.59) MAPTMEN1KMT2ASMN1; SMN2TAS1R3
SCHEMBL91391 0.85 KDM4E (0.69) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16607117 0.83 MAPT (0.73) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL77958 0.82 SMN1; SMN2 (0.77) MAPTMEN1KMT2ASMN1; SMN2TAS1R3
SCHEMBL7375409 0.78 MAPK1 (0.54) MAPTSMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL24769869 0.78 KDM4E (0.46) MAPTMEN1KMT2ASMN1; SMN2TAS1R3
SCHEMBL10084283 0.77 SMN1; SMN2 (0.68) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL91458 0.76 ALDH1A1 (0.54) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2612387 0.75 SMN1; SMN2 (0.73) MAPTKMT2ASMN1; SMN2KDM4ENPC1

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-8129415-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-03-06 US disclosed
US-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-07-30 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-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 MAPT 2769/4885MEN1 930/4885KMT2A 609/4885

“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.