SCHEMBL3560430

SCHEMBL3560430

COC(=O)c1cnc(C)c(C(=O)O)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 5/20 0.37
TSHR P16473 1/20 0.36
LMNA P02545 1/20 0.35
ABL1 P00519 1/20 0.35
HPGD P15428 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
NR3C1 P04150 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
SCHEMBL10767045 0.85 KDM4E (0.50) KDM4EKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL31923 0.83 MAPT (0.43) KDM4EKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL3554940 0.81 KDM4E (0.46) KDM4EKMT2AMEN1L3MBTL1MAPT
SCHEMBL754657 0.79 SMN1; SMN2 (0.40) KDM4EKMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL2649515 0.79 MAPT (0.40) KDM4EKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL2650690 0.79 SMN1; SMN2 (0.40) KDM4EKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL28293263 0.77 KDM4E (0.40) KDM4EKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL192118 0.75 MAPT (0.40) KDM4EKMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL1341382 0.75 SMN1; SMN2 (0.39) KDM4EKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL28041813 0.74 KDM4E (0.41) KDM4ESMN1; SMN2L3MBTL1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7659307-B2 Nonphytotoxic; 4-Bromo-3-methoxy-N-4-[4(trifluoromethyl)phenoxy]phenyl-thiophene-2-carboxamide; 4-[(Allyloxycarbonyl)amino]-3-methoxy-N-4-[4-(trifluoromethyl)phenoxy]phenyl-thiophene-2-carboxamide BAYER CROPSCIENCE S.A. (FR) 2010-02-09 US disclosed
US-20060205732-A1 Heterocyclic carboxamides and their use as fungicides BAYER SAS (FR) 2006-09-14 US disclosed
US-7084163-B2 Heterocyclic carboxamides and their use as fungicides BAYER CROPSCIENCE S.A. (FR) 2006-08-01 US disclosed
US-20040152698-A1 Heterocyclic carboxamides and their use as fungicides BAYER SAS (FR) 2004-08-05 US disclosed
EP-1425276-A2 HETEROCYCLIC CARBOXAMIDES AND THEIR USE AS FUNGICIDES Bayer CropScience S.A. (FR) 2004-06-09 EP disclosed
WO-2003006454-A2 HETEROCYCLIC CARBOXAMIDES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE S.A. (FR) 2003-01-23 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 (2 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-20040152698-A1 Heterocyclic carboxamides and their use as fungicides CYP1A2, CYP4X1, CYCS KDM4E 543/4885KMT2A 333/4885MEN1 3722/4885
US-20060205732-A1 Heterocyclic carboxamides and their use as fungicides CYP4X1, CYP1A2, CYCS KDM4E 501/4885KMT2A 358/4885MEN1 3989/4885

“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.