SCHEMBL6740204

SCHEMBL6740204

CCCCOC(=O)N(c1ccc(N)cc1)c1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.52
LMNA P02545 2/20 0.52
CYP1A2 P05177 2/20 0.52
TSHR P16473 2/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
PDE4D Q08499 1/20 0.52
ALDH1A1 P00352 5/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 2/20 0.47
GAA P10253 2/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
CYP2D6 P10635 1/20 0.46
DRD3 P35462 1/20 0.46
SCN1A P35498 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KCNH2 Q12809 1/20 0.46
SCN2A Q99250 1/20 0.46

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
SCHEMBL6740971 0.87 CYP3A4 (0.54) CYP3A4LMNACYP1A2TSHRCYP2C9
SCHEMBL28033051 0.80 LMNA (0.58) CYP3A4LMNACYP1A2TSHRCYP2C9
SCHEMBL6082056 0.78 TSHR (0.56) CYP3A4LMNACYP1A2TSHRCYP2C9
SCHEMBL29042899 0.77 TSHR (0.54) CYP3A4LMNACYP1A2TSHRCYP2C19
SCHEMBL8537398 0.77 PTGIR (0.43) LMNATSHRALDH1A1MAPTGAA
SCHEMBL9228232 0.77 LMNA (0.55) CYP3A4LMNACYP1A2TSHRCYP2C9
SCHEMBL3661310 0.75 KEAP1 (0.49) LMNATSHRALDH1A1NPC1MAPT
SCHEMBL17377345 0.74 GAA (0.39) LMNATSHRALDH1A1NPC1MAPT
SCHEMBL16682336 0.73 LMNA (0.54) CYP3A4LMNACYP1A2TSHRCYP2C9
SCHEMBL14975876 0.73 TSHR (0.50) CYP3A4LMNACYP1A2TSHRCYP2C9

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
US-20040063783-A1 Nitroso diphenylamine derivatives MERCK PATENT GMBH (DE) 2004-04-01 US disclosed
EP-1322598-A1 NITROSO DIPHENYLAMINE DERIVATIVES MERCK PATENT GmbH (DE) 2003-07-02 EP disclosed
WO-2002028820-A1 NITROSO DIPHENYLAMINE DERIVATIVES MERCK PATENT GMBH (DE) 2002-04-11 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 (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-20040063783-A1 Nitroso diphenylamine derivatives NQO2, SULT1A1, NAT1 CYP3A4 1241/4885LMNA 1575/4885CYP1A2 98/4885

“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.