SCHEMBL4256236

SCHEMBL4256236

O=C(NS(=O)(=O)C=Cc1ccccn1)c1ccc(F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.49
NFE2L2 Q16236 6/20 0.47
NLRP3 Q96P20 1/20 0.46
CYP2D6 P10635 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
EGFR P00533 1/20 0.42
KMT2A Q03164 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
AGTR1 P30556 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
SCHEMBL4256232 1.00 GRM4 (0.49) GRM4NFE2L2NLRP3CYP2D6RAB9A
SCHEMBL4264693 0.88 FLT1 (0.53) NFE2L2NLRP3RAB9ASMN1; SMN2FLT1
SCHEMBL4262688 0.88 FLT1 (0.53) NFE2L2NLRP3RAB9ASMN1; SMN2FLT1
SCHEMBL4260889 0.86 FLT1 (0.49) NFE2L2NLRP3RAB9AFLT1FLT4
SCHEMBL4255200 0.86 NFE2L2 (0.47) NFE2L2NLRP3RAB9AEGFRKMT2A
SCHEMBL4260881 0.86 FLT1 (0.49) NFE2L2NLRP3RAB9AFLT1FLT4
SCHEMBL4255193 0.86 NFE2L2 (0.47) NFE2L2NLRP3RAB9AEGFRKMT2A
SCHEMBL4255194 0.84 NFE2L2 (0.46) GRM4NFE2L2NLRP3FLT1FLT4
SCHEMBL4255188 0.84 NFE2L2 (0.46) GRM4NFE2L2NLRP3FLT1FLT4
SCHEMBL4255393 0.84 PYGL (0.43) NFE2L2CYP2D6RAB9ASMN1; SMN2FLT1

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
EP-1904471-B1 HETEROARYLETHENYL DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS HOFFMANN LA ROCHE (CH) 2009-10-21 EP claimed
US-7208506-B2 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. (US) 2007-04-24 US claimed
US-20070010564-A1 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. 2007-01-11 US claimed
EP-1904471-B1 HETEROARYLETHENYL DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS HOFFMANN LA ROCHE (CH) 2009-10-21 EP disclosed
US-7208506-B2 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. (US) 2007-04-24 US disclosed
US-20070010564-A1 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. 2007-01-11 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-20070010564-A1 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents CYP3A43, CYP1A1, CYP3A5 GRM4 3743/4885NFE2L2 270/4885NLRP3 1732/4885

“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.