SCHEMBL5962221

SCHEMBL5962221

CCOC(=O)c1cn(CC)c2cnc(Br)cc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
POLB P06746 1/20 0.54
ALDH1A1 P00352 6/20 0.51
HPGD P15428 5/20 0.51
KDM4E B2RXH2 5/20 0.51
HSD17B10 Q99714 3/20 0.51
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49
MEN1 O00255 2/20 0.49
THRB P10828 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
TSHR P16473 4/20 0.45
HTT P42858 2/20 0.45
CYP1A2 P05177 1/20 0.45
RXFP1 Q9HBX9 1/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPK1 P28482 1/20 0.42
P2RX3 P56373 1/20 0.42
NPC1 O15118 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
SCHEMBL5962157 0.88 LMNA (0.53) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL5962175 0.88 LMNA (0.53) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL5962176 0.87 LMNA (0.52) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL3317458 0.86 LMNA (0.61) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL5962219 0.85 LMNA (0.50) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL5962230 0.85 LMNA (0.53) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL3692565 0.84 LMNA (0.49) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL3697710 0.84 LMNA (0.49) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL5962220 0.84 LMNA (0.50) LMNAPOLBALDH1A1HPGDKDM4E
SCHEMBL5962241 0.83 ALDH1A1 (0.52) LMNAPOLBALDH1A1HPGDKDM4E

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-8569484-B2 Heterocyclic urea derivatives and methods of use thereof ASTRAZENECA AB (SE) 2013-10-29 US disclosed
US-8569484-B2 Heterocyclic urea derivatives and methods of use thereof ASTRAZENECA AB (SE) 2013-10-29 US disclosed
US-20120122817-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2012-05-17 US disclosed
US-20120122817-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2012-05-17 US disclosed
WO-2010136817-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-12-02 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-20120122817-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF UROD, UMPS, SLC14A1 LMNA 2498/4885POLB 863/4885ALDH1A1 847/4885

“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.