SCHEMBL3557284

SCHEMBL3557284

CN(C)N=C1C=CC(NC(=O)C(NC(=O)Nc2ccc(Cl)cc2)c2ccccc2)=C(F)C1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.40
CNR1 P21554 2/20 0.40
MAPT P10636 1/20 0.40
FPR2 P25090 1/20 0.39
EP300 Q09472 6/20 0.38
CASR P41180 1/20 0.38
NPY5R Q15761 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL3573299 0.88 CNR1 (0.41) UTS2RCNR1MAPTFPR2EP300
SCHEMBL3569301 0.84 CNR1 (0.39) CNR1MAPTFPR2EP300CASR
SCHEMBL3565837 0.84 CNR1 (0.39) CNR1MAPTFPR2EP300CASR
SCHEMBL3559267 0.83 FPR2 (0.42) UTS2RCNR1MAPTFPR2EP300
SCHEMBL3557282 0.81 UTS2R (0.40) UTS2RCNR1MAPTFPR2EP300
SCHEMBL5813569 0.79 ALDH1A1 (0.39) CNR1MAPTNPY5RALDH1A1TSHR
SCHEMBL3569620 0.79 CNR1 (0.34) UTS2RCNR1MAPTALDH1A1TSHR
SCHEMBL3573284 0.75 CNR1 (0.36) UTS2RCNR1MAPTALDH1A1
SCHEMBL3567078 0.75 MAPT (0.43) UTS2RCNR1MAPTFPR2EP300
SCHEMBL3570085 0.74 FPR2 (0.42) UTS2RCNR1MAPTFPR2EP300

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-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US claimed
US-20060160821-A1 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2006-07-20 US claimed
US-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US disclosed
US-20060160821-A1 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2006-07-20 US disclosed
WO-2006063113-A2 UREAS AS FACTOR XA INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2006-06-15 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-20060160821-A1 Ureas as factor Xa inhibitors TFPI, F12, F11 UTS2R 52/4885CNR1 1500/4885MAPT 1933/4885

“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.