SCHEMBL4176670

SCHEMBL4176670

Cc1ccc(C)n1-c1ccc2c(c1)CCNC2C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.47
DRD2 P14416 2/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 2/20 0.47
CYP2C9 P11712 1/20 0.47
DRD3 P35462 1/20 0.47
HIF1A Q16665 1/20 0.47
DRD4 P21917 1/20 0.47
ALDH1A1 P00352 3/20 0.41
CYP2D6 P10635 1/20 0.41
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM1A O60341 1/20 0.35
PRCP P42785 1/20 0.35

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
SCHEMBL7820935 0.77 MAOA (0.56) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL1009080 0.75 OPRM1 (0.45) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL4166735 0.72 MAOA (0.54) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL6304692 0.72 HTR2C (0.47) DRD2KDM4EALDH1A1LMNAMEN1
SCHEMBL1010996 0.72 MAOA (0.54) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL6159366 0.72 HTR2A (0.61) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL22680299 0.72 MAOA (0.54) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL21959060 0.72 MAOA (0.64) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL22680298 0.72 MAOA (0.54) MAOADRD2TSHRHSD17B10KDM4E
SCHEMBL626535 0.72 MAOA (0.54) MAOADRD2TSHRHSD17B10KDM4E

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-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
US-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
US-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
EP-1869010-A1 3-SULFONYLAMINO-PYRROLIDINE-2-ONE DERIVATIVES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2007-12-26 EP disclosed
WO-2006108709-A1 3-SULFONYLAMINO-PYRROLIDINE-2-ONE DERIVATIVES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2006-10-19 WO disclosed
WO-2006108709-A1 3-SULFONYLAMINO-PYRROLIDINE-2-ONE DERIVATIVES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2006-10-19 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-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors TFPI, SERPINC1, SERPINE1 MAOA 671/4885DRD2 4206/4885TSHR 1343/4885

“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.