Urea

Urea

SCHEMBL3678424

NC(N)=O.Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.63
CYP3A4 P08684 1/20 0.63
NPC1 O15118 1/20 0.53
CYP19A1 P11511 1/20 0.52
ALDH1A1 P00352 5/20 0.52
LMNA P02545 3/20 0.52
TSHR P16473 4/20 0.48
MAPT P10636 3/20 0.47
GPR35 Q9HC97 1/20 0.47
POLB P06746 1/20 0.45
HTT P42858 1/20 0.45
CES1 P23141 1/20 0.45

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
SCHEMBL65293 0.91 CYP19A1 (0.62) SMN1; SMN2CYP3A4NPC1CYP19A1ALDH1A1
Acrylamide SCHEMBL27801304 0.86 SMN1; SMN2 (0.53) SMN1; SMN2CYP3A4NPC1CYP19A1ALDH1A1
SCHEMBL539064 0.85 ALDH1A1 (0.60) SMN1; SMN2CYP3A4NPC1CYP19A1ALDH1A1
SCHEMBL5538329 0.85 CYP19A1 (0.62) SMN1; SMN2CYP3A4CYP19A1ALDH1A1LMNA
SCHEMBL1172383 0.84 SMN1; SMN2 (0.78) SMN1; SMN2CYP3A4NPC1ALDH1A1LMNA
SCHEMBL3913976 0.80 ALDH1A1 (0.50) SMN1; SMN2CYP3A4NPC1CYP19A1ALDH1A1
SCHEMBL1718796 0.80 ALDH1A1 (0.50) SMN1; SMN2CYP3A4NPC1CYP19A1ALDH1A1
SCHEMBL91307 0.79 NPC1 (0.59) SMN1; SMN2CYP3A4NPC1ALDH1A1LMNA
SCHEMBL18983905 0.79 NPC1 (0.59) SMN1; SMN2CYP3A4NPC1ALDH1A1LMNA
SCHEMBL7083340 0.78 NPC1 (0.62) SMN1; SMN2CYP3A4NPC1CYP19A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794621-B1 NOVEL ORGANOSILICA COMPOUNDS UNIV GENT (BE) 2018-09-26 EP disclosed
US-9181282-B2 Organosilica compounds UNIVERSITEIT GENT (BE) 2015-11-10 US disclosed
US-20150005525-A1 NOVEL ORAGNOSILICA COMPOUNDS UNIVERSITEIT GENT (BE) 2015-01-01 US disclosed
EP-2794621-A1 NOVEL ORGANOSILICA COMPOUNDS Universiteit Gent (BE) 2014-10-29 EP disclosed
WO-2013093022-A1 NOVEL ORGANOSILICA COMPOUNDS UNIVERSITEIT GENT (BE) 2013-06-27 WO disclosed
US-20100032547-A1 METHOD AND SYSTEM OF ARRAY IMAGING TUFTS UNIVERSITY (US) 2010-02-11 US disclosed
EP-1960748-A2 METHOD AND SYSTEM OF ARRAY IMAGING Tufts University (US) 2008-08-27 EP disclosed
WO-2008051189-A2 METHOD AND SYSTEM OF ARRAY IMAGING TUFTS UNIVERSITY (US) 2008-05-02 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-20150005525-A1 NOVEL ORAGNOSILICA COMPOUNDS ORC3, ORMDL3, OR10J3 SMN1; SMN2 4780/4885CYP3A4 1310/4885NPC1 2957/4885

“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.