SCHEMBL14217340

SCHEMBL14217340

Cc1cc(OS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc([N+](=O)[O-])c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.44
MAOA P21397 1/20 0.42
CYP1A1 P04798 9/20 0.39
GPR17 Q13304 2/20 0.39
P2RY2 P41231 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL12353773 0.92 MAOA (0.41) F2MAOACYP1A1GPR17P2RY2
SCHEMBL2304336 0.89 CYP1A1 (0.45) F2CYP1A1SMN1; SMN2LMNAALDH1A1
SCHEMBL2303981 0.84 GPR17 (0.49) GPR17P2RY2
SCHEMBL14217380 0.84 CYP1A1 (0.42) F2CYP1A1SMN1; SMN2LMNAALDH1A1
SCHEMBL14217346 0.84 F2 (0.43) F2CYP1A1SMN1; SMN2LMNAALDH1A1
SCHEMBL2300461 0.84 ALDH1A1 (0.48) MAOASMN1; SMN2LMNAALPLALPI
SCHEMBL14217369 0.83 CYP1A1 (0.53) F2CYP1A1SMN1; SMN2LMNAALPL
SCHEMBL14708686 0.83 CYP1A1 (0.46) F2CYP1A1SMN1; SMN2LMNAALDH1A1
SCHEMBL12353905 0.81 ALDH1A1 (0.51) CYP1A1GPR17P2RY2SMN1; SMN2LMNA
SCHEMBL2302473 0.80 HPGD (0.43) MAOASMN1; SMN2LMNAALPLALPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9034888-B2 Substituted 2-imidazolidones and analogs UNIVERSITE LAVAL (CA) 2015-05-19 US disclosed
US-20120309777-A1 SUBSTITUTED 2-IMIDAZOLIDONES AND ANALOGS UNIVERSITE LAVAL (CA) 2012-12-06 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-20120309777-A1 SUBSTITUTED 2-IMIDAZOLIDONES AND ANALOGS CCNY, RPS4Y1, TPX2 F2 3607/4885MAOA 3620/4885CYP1A1 1777/4885

“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.