SCHEMBL3564411

SCHEMBL3564411

CN(C)N=C1C=CC(NC(=O)C(NC(=O)Nc2ccc(Cl)cc2)c2ccccc2Br)=CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.36
FPR2 P25090 1/20 0.36
UTS2R Q9UKP6 5/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MAPT P10636 4/20 0.35
RAB9A P51151 3/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 3/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.33
GAA P10253 1/20 0.33
CRHR1 P34998 1/20 0.33
IDH1 O75874 1/20 0.33

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
SCHEMBL3566489 0.92 UTS2R (0.37) CNR1UTS2RMEN1KMT2ASMN1; SMN2
SCHEMBL3560347 0.91 RAB9A (0.38) CNR1UTS2RMEN1KMT2ASMN1; SMN2
SCHEMBL3564560 0.90 UTS2R (0.36) CNR1FPR2UTS2RMEN1KMT2A
SCHEMBL3573284 0.90 CNR1 (0.36) CNR1UTS2RMEN1KMT2ASMN1; SMN2
SCHEMBL3564975 0.89 LMNA (0.40) CNR1FPR2UTS2RMEN1KMT2A
SCHEMBL3559267 0.89 FPR2 (0.42) CNR1FPR2UTS2RMEN1KMT2A
SCHEMBL3567223 0.86 CNR1 (0.34) CNR1FPR2MEN1KMT2ASMN1; SMN2
SCHEMBL3570284 0.84 FPR2 (0.43) CNR1FPR2MEN1KMT2ASMN1; SMN2
SCHEMBL3567171 0.84 HTT (0.42) CNR1UTS2RMEN1KMT2ASMN1; SMN2
SCHEMBL3567078 0.80 MAPT (0.43) CNR1FPR2UTS2RMEN1KMT2A

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 CNR1 1500/4885FPR2 2332/4885UTS2R 52/4885

“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.