SCHEMBL14914726

SCHEMBL14914726

C[SiH](C)OC(c1ccc2cc(N)ccc2n1)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.45
CASP6 P55212 1/20 0.45
PLAU P00749 1/20 0.44
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
F2 P00734 1/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
MAOA P21397 1/20 0.36
DRD1 P21728 1/20 0.36
ACHE P22303 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL13825561 0.83 BACE1 (0.41) ALDH1A1BACE1
SCHEMBL3387686 0.76 KDM4E (0.36) KDM4EPOLB
SCHEMBL9983517 0.75 BACE1 (0.40) HTTBACE1
SCHEMBL27314053 0.73 KDM4E (0.58) KDM4ELMNAPOLBCASP6PLAU
SCHEMBL3534070 0.73 NOS3 (0.36) NCF1
SCHEMBL1785768 0.72 POLB (0.43) POLBHRH3HSP90AA1AAK1
SCHEMBL4406045 0.70 MAPT (0.33) MEN1ACHEKMT2AALDH1A1MAPT
SCHEMBL4899053 0.69 COPS5 (0.32) ALDH1A1MAPTSMN1; SMN2
SCHEMBL631423 0.68 CYP3A4 (0.35) SLC6A2SLC6A4SLC6A3KCNH2ALDH1A1
SCHEMBL2927486 0.68 KDM4E (0.47) KDM4ELMNAPOLBCASP6PLAU

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-8993767-B2 Multiphoton activable quinoline derivatives, their preparation and their uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-03-31 US disclosed
EP-2523937-B1 Multiphoton activable quinoline derivatives, their preparation and their uses CENTRE NAT RECH SCIENT (FR) 2015-03-11 EP disclosed
US-20130116281-A1 Multiphoton Activable Quinoline Derivatives, Their Preparation and Their Uses UNIVERSITÉ PARIS CITÉ (FR) 2013-05-09 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-20130116281-A1 Multiphoton Activable Quinoline Derivatives, Their Preparation and Their Uses NQO2, ACHE, NQO1 KDM4E 2288/4885LMNA 2819/4885POLB 523/4885

“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.