SCHEMBL6097331

SCHEMBL6097331

O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 9/20 0.79
KMT2A Q03164 4/20 0.79
SMN1; SMN2 Q16637 3/20 0.79
MEN1 O00255 3/20 0.79
MAPT P10636 3/20 0.79
PPARG P37231 3/20 0.79
LMNA P02545 2/20 0.79
CYP3A4 P08684 2/20 0.79
MAPK1 P28482 2/20 0.79
PKM P14618 2/20 0.79
TP53 P04637 1/20 0.79
CYP1A2 P05177 1/20 0.79
CYP2D6 P10635 1/20 0.79
CYP2C9 P11712 1/20 0.79
TSHR P16473 1/20 0.79
NFKB1 P19838 1/20 0.79
CYP2C19 P33261 1/20 0.79
THPO P40225 1/20 0.79
MTOR P42345 1/20 0.79
PMP22 Q01453 1/20 0.79

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
SCHEMBL29369092 0.89 RORC (1.00) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL420231 0.89 RORC (1.00) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL27676843 0.87 MEN1 (0.74) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL7129256 0.86 RORC (0.85) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL7125062 0.86 RORC (0.85) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL7130609 0.86 RORC (0.84) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL11911348 0.85 MAPT (0.76) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL19066460 0.84 MAPT (1.00) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL18147432 0.83 RORC (0.80) RORCKMT2ASMN1; SMN2MEN1MAPT
SCHEMBL7121705 0.83 RORC (0.80) RORCKMT2ASMN1; SMN2MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1289072-C Aniline derivatives or salts thereof and cytokine prodn inhibitors contg. same ISHIHARA SANGYO KAISHA (JP) 2006-12-13 CN disclosed
US-7132546-B2 Aniline derivatives or salts thereof and cytokine production inhibitors containing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-11-07 US disclosed
US-20040048891-A1 Aniline derivatives or salts thereof and cytokine production inhibitors containing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 2004-03-11 US disclosed
CN-1481238-A Aniline derivative or salt thereof and cytokine production inhibitor containing the same 石原产业株式会社 2004-03-10 CN disclosed
EP-1344525-A1 ANILINE DERIVATIVES OR SALTS THEREOF AND CYTOKINE PRODUCTION INHIBITORS CONTAINING THE SAME ISHIHARA SANGYO KAISHA, LTD. (JP) 2003-09-17 EP 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-20040048891-A1 Aniline derivatives or salts thereof and cytokine production inhibitors containing the same IL2, IL4I1, IFNG RORC 726/4885KMT2A 3083/4885SMN1; SMN2 4799/4885

“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.