SCHEMBL14217384

SCHEMBL14217384

CCCN1CCN(c2ccc(S(=O)(=O)Nc3cc(CC)cc(OC)c3)cc2)C1=O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 8/20 0.56
PKM P14618 2/20 0.45
HTR6 P50406 1/20 0.44
ALDH1A1 P00352 1/20 0.43
ADRB2 P07550 6/20 0.42
ADRB1 P08588 6/20 0.42
ADRB3 P13945 6/20 0.42
KMT2A Q03164 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
SCHEMBL14119726 0.93 CYP1A1 (0.63) CYP1A1PKMHTR6ADRB2ADRB1
SCHEMBL14120067 0.86 CYP1A1 (0.56) CYP1A1PKMALDH1A1
SCHEMBL14217381 0.84 PKM (0.54) CYP1A1PKMALDH1A1ADRB2ADRB1
SCHEMBL14119673 0.83 CYP1A1 (0.70) CYP1A1ADRB2ADRB1ADRB3
SCHEMBL14217385 0.83 CYP1A1 (0.79) CYP1A1PKM
SCHEMBL14217387 0.82 CYP1A1 (0.63) CYP1A1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL14119984 0.79 MAPT (0.53) CYP1A1PKMALDH1A1ADRB2ADRB1
SCHEMBL14119612 0.79 ADRB2 (0.50) CYP1A1PKMALDH1A1ADRB2ADRB1
SCHEMBL14217382 0.78 ALDH1A1 (0.54) CYP1A1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL12353998 0.78 PKM (0.61) CYP1A1PKMADRB2ADRB1ADRB3

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 CYP1A1 1777/4885PKM 2928/4885HTR6 4117/4885

“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.