SCHEMBL6679100

SCHEMBL6679100

O=C(Nc1nc(C(F)(F)F)c(Cl)s1)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.53
MEN1 O00255 5/20 0.53
MAPT P10636 5/20 0.53
LMNA P02545 2/20 0.53
POLB P06746 1/20 0.53
XBP1 P17861 1/20 0.53
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HTT P42858 2/20 0.52
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 1/20 0.51
ALPL P05186 1/20 0.50
PKM P14618 1/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MCL1 Q07820 1/20 0.49
STAT3 P40763 1/20 0.48
HPGD P15428 1/20 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
SCHEMBL4910888 0.78 KMT2A (0.71) KMT2AMEN1MAPTLMNAMAPK1
SCHEMBL7239127 0.77 GRM5 (0.54) KMT2AMEN1MAPTLMNAHTT
SCHEMBL27942773 0.74 VCAM1 (0.64) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL1455231 0.74 STAT3 (0.63) KMT2AMEN1MAPTLMNAHTT
SCHEMBL1454378 0.74 STAT3 (0.59) KMT2AMEN1MAPTLMNAHTT
SCHEMBL1454189 0.74 ALDH1A1 (0.67) KMT2AMAPTLMNAPOLBMAPK1
SCHEMBL6679281 0.74 TAS1R3 (0.50) KMT2AMEN1MAPTMAPK1KDM4E
SCHEMBL16119638 0.72 ALDH1A1 (0.62) KMT2AMEN1MAPTHTTALDH1A1
SCHEMBL1455286 0.72 KMT2A (0.90) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL5835824 0.72 STAT3 (0.59) KMT2AMEN1MAPTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004056177-A2 INSECTICIDAL AMINOTHIAZOLE DERIVATIVES NIPPON SODA CO. LTD. (JP) 2004-07-08 WO disclosed
US-6737382-B1 WIDE SPECTRUM OF PLANT PROTECTING ACTIVITY NIPPON SODA CO. LTD. (JP) 2004-05-18 US disclosed
US-20040082629-A1 INSECTICIDAL AMINOTHIAZOLE DERIVATIVES NIPPON SODA CO., LTD. 2004-04-29 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-20040082629-A1 INSECTICIDAL AMINOTHIAZOLE DERIVATIVES SCN7A, SCN2B, CASP7 KMT2A 1863/4885MEN1 4500/4885MAPT 4148/4885

“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.