SCHEMBL2989308

SCHEMBL2989308

CCOC(=O)c1cn(CCCOC)c2ccc(I)cc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
CNR1 P21554 5/20 0.51
CNR2 P34972 5/20 0.51
KMT2A Q03164 2/20 0.47
HPGD P15428 4/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
PTPN1 P18031 1/20 0.45
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 3/20 0.43
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
MAP2K2 P36507 1/20 0.41
MAP2K1 Q02750 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
SCHEMBL1431209 0.94 LMNA (0.57) LMNACNR1CNR2KMT2AHPGD
SCHEMBL1552946 0.90 LMNA (0.58) LMNACNR1CNR2KMT2AHPGD
SCHEMBL3006908 0.89 LMNA (0.57) LMNACNR1CNR2KMT2AHPGD
SCHEMBL5245640 0.89 CNR2 (0.60) LMNACNR1CNR2KMT2AHPGD
SCHEMBL4141591 0.88 LMNA (0.61) LMNACNR1CNR2KMT2AHPGD
SCHEMBL3004121 0.87 LMNA (0.60) LMNACNR1CNR2KMT2AHPGD
SCHEMBL13048082 0.86 LMNA (0.58) LMNACNR1CNR2KMT2AHPGD
SCHEMBL1429954 0.85 LMNA (0.74) LMNACNR1CNR2KMT2AHPGD
SCHEMBL2991257 0.84 LMNA (0.56) LMNACNR1CNR2KMT2AHPGD
SCHEMBL10086154 0.82 LMNA (0.60) LMNACNR1CNR2KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283361-B2 Heterocyclic urea derivatives and methods of use thereof ASTRAZENECA AB (SE) 2012-10-09 US disclosed
US-8283361-B2 Heterocyclic urea derivatives and methods of use thereof ASTRAZENECA AB (SE) 2012-10-09 US disclosed
US-20100190745-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-07-29 US disclosed
US-20100190745-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-07-29 US disclosed
US-20100190745-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-07-29 US disclosed
WO-2009147433-A1 HETEROCYCLIC UREA DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2009-12-10 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-20100190745-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF UROD, UMPS, SLC14A1 LMNA 2705/4885CNR1 1347/4885CNR2 1306/4885

“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.