SCHEMBL3729474

SCHEMBL3729474

NC(=O)c1cc2ccc3cccc4ccc(c1C(N)=O)c2c34

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
KDM4E B2RXH2 3/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 3/20 0.44
CYP1A2 P05177 3/20 0.44
MEN1 O00255 2/20 0.44
ERBB2 P04626 1/20 0.44
FYN P06241 1/20 0.44
MAOA P21397 1/20 0.44
ACHE P22303 1/20 0.44
AHR P35869 1/20 0.44
HPGD P15428 4/20 0.43
HSD17B10 Q99714 3/20 0.43
GLA P06280 1/20 0.43
POLB P06746 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.41
IKBKB O14920 1/20 0.39
CYP3A4 P08684 2/20 0.39
TSHR P16473 2/20 0.39

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
SCHEMBL4507351 0.84 KDM4E (0.49) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL5749027 0.83 ALDH1A1 (0.45) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL5748114 0.83 KMT2A (0.44) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL16011384 0.82 KDM4E (0.44) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL5013946 0.82 KDM4E (0.44) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL31124805 0.82 KDM4E (0.44) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL1535021 0.80 ALDH1A1 (0.57) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL29837346 0.80 ALDH1A1 (0.57) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL27995925 0.79 KMT2A (0.45) ALDH1A1KDM4EGAAKMT2ACYP1A2
SCHEMBL27731099 0.79 KMT2A (0.45) ALDH1A1KDM4EGAAKMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671184-B2 Molecular beacons Universitact Bern (CH) 2010-03-02 US disclosed
US-20080064033-A1 Molecular Beacons UNIVERSITAET BERN (CH) 2008-03-13 US disclosed
EP-1799853-A2 MOLECULAR BEACONS Universität Bern (CH) 2007-06-27 EP disclosed
CN-1917919-A Cosmetic method using chemiluminescence, luminophor for irradiating skin for beauty, and cosmetic and cosmetology product FANCL CORP (JP) 2007-02-21 CN disclosed
WO-2006032487-A2 MOLECULAR BEACONS Universität Bern (CH) 2006-03-30 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-20080064033-A1 Molecular Beacons POLRMT, POLI, INCENP ALDH1A1 3198/4885KDM4E 3454/4885GAA 1172/4885

“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.