SCHEMBL3570295

SCHEMBL3570295

O=C(Nc1ccc(Cl)cc1)NC(C(=O)Nc1ccc(-c2cc[n+]([O-])cc2)cc1)c1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.42
CNR1 P21554 13/20 0.41
CNR2 P34972 1/20 0.39
GRIK1 P39086 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
GAA P10253 1/20 0.37
ATM Q13315 1/20 0.37
GPR55 Q9Y2T6 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
SCHEMBL3559165 0.88 CNR1 (0.38) UTS2RCNR1CNR2MEN1KMT2A
SCHEMBL3570081 0.87 UTS2R (0.42) UTS2RCNR1GRIK1MEN1KMT2A
SCHEMBL3557262 0.86 CNR1 (0.50) CNR1MEN1KMT2AMAPTHTT
SCHEMBL3569304 0.79 CNR1 (0.52) CNR1CNR2MEN1KMT2AMAPT
SCHEMBL3570183 0.78 RAB9A (0.45) CNR1MEN1KMT2AMAPTHTT
SCHEMBL3570562 0.77 UTS2R (0.44) UTS2RCNR1CNR2MEN1KMT2A
SCHEMBL3560100 0.77 PCTP (0.45) UTS2RCNR1MEN1KMT2AMAPT
SCHEMBL8264048 0.77 F10 (0.44) UTS2RCNR1CNR2MEN1KMT2A
SCHEMBL3570293 0.77 GAA (0.36) UTS2RCNR1CNR2MEN1KMT2A
SCHEMBL3564018 0.77 F10 (0.43) UTS2RCNR1MAPT

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-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-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 1500/4885CNR2 1984/4885

“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.