SCHEMBL3574004

SCHEMBL3574004

CN1CCN=C1c1ccc(NC(=O)C(NC(=O)Nc2ccc(Cl)cc2)c2cccc(Cl)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.46
F10 P00742 5/20 0.44
EP300 Q09472 6/20 0.40
UTS2R Q9UKP6 1/20 0.38
HTR2A P28223 1/20 0.38
CNR1 P21554 2/20 0.38
CYP1A2 P05177 1/20 0.37
IGF1R P08069 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL3565027 0.92 EP300 (0.48) F10EP300UTS2RCNR1
SCHEMBL3570136 0.92 EP300 (0.48) F10EP300UTS2RCNR1
SCHEMBL3564096 0.92 EP300 (0.48) F10EP300UTS2RCNR1
SCHEMBL3562900 0.87 LMNA (0.45) F10EP300CNR1CYP3A4CYP2C9
SCHEMBL3563371 0.86 CNR1 (0.49) ROCK2F10EP300UTS2RCNR1
SCHEMBL3561245 0.86 ROCK2 (0.41) ROCK2F10EP300UTS2RCNR1
SCHEMBL8263579 0.85 KMT2A (0.48) CNR1
SCHEMBL3569137 0.84 F10 (0.40) ROCK2F10EP300UTS2RCNR1
SCHEMBL3558912 0.84 F10 (0.45) F10EP300UTS2RCNR1
SCHEMBL3568353 0.83 F10 (0.44) F10EP300UTS2RCNR1

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 7 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-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 US disclosed
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 ROCK2 3506/4885F10 9/4885EP300 3505/4885

“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.