SCHEMBL1925007

SCHEMBL1925007

Cn1cc(C(=O)c2ccc3ccccc3c2)c2c(Br)cccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.47
POLB P06746 1/20 0.44
CNR1 P21554 3/20 0.44
MAPK1 P28482 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
GMNN O75496 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
CYP2C19 P33261 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
HIF1A Q16665 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 1/20 0.43

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
SCHEMBL3580870 0.75 POLB (0.44) CNR2POLBCNR1LMNANPSR1
SCHEMBL28045859 0.74 POLB (0.41) CNR2POLBCNR1LMNANPSR1
SCHEMBL1924214 0.72 SMN1; SMN2 (0.48) MAPK1NPSR1MEN1MAPTKMT2A
SCHEMBL20604979 0.72 NR4A2 (0.59) CYP1A2CYP2C19MEN1MAPTKMT2A
SCHEMBL7501630 0.72 KMT2A (0.40) CNR2POLBCNR1LMNANPSR1
SCHEMBL7469126 0.71 ABCG2 (0.52) MAPK1HPGDCYP1A2CYP2C19MEN1
SCHEMBL7928540 0.68 CYP1A2 (0.52) POLBMAPK1HPGDLMNACYP1A2
SCHEMBL941698 0.67 CES2 (0.74) MAPK1HPGDCYP3A4ALOX15MEN1
SCHEMBL30250451 0.67 CES2 (0.74) MAPK1HPGDCYP3A4ALOX15MEN1
SCHEMBL29613672 0.67 CES2 (0.74) MAPK1HPGDCYP3A4ALOX15MEN1

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
EP-1812426-B1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE DECODE GENETICS EHF (IS) 2011-06-08 EP disclosed
US-20090075985-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE DECODE GENETICS INC. (US) 2009-03-19 US disclosed
EP-1812426-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE Decode Genetics, Inc. (US) 2007-08-01 EP disclosed
US-20060142348-A1 Aryl sulfonamide peri-substituted bicyclics for occlusive artery disease DECODE CHEMISTRY, INC. (US) 2006-06-29 US disclosed
WO-2006044405-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE DECODE GENETICS, INC. (US) 2006-04-27 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 (2 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-20060142348-A1 Aryl sulfonamide peri-substituted bicyclics for occlusive artery disease PTGIS, PTGIR, TBXA2R CNR2 280/4885POLB 465/4885CNR1 594/4885
US-20090075985-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE PTGIS, PTGIR, TBXA2R CNR2 280/4885POLB 465/4885CNR1 594/4885

“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.