SCHEMBL4688501

SCHEMBL4688501

CNc1cc2ccn(-c3ccc(NC(=O)NS(=O)(=O)c4ccc(Cl)s4)cc3CO)c(=O)c2cc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 3/20 0.56
FBP1 P09467 1/20 0.34
MAPT P10636 3/20 0.33
SLC22A12 Q96S37 1/20 0.32
F10 P00742 2/20 0.32
F2 P00734 1/20 0.31
MEN1 O00255 4/20 0.31
KMT2A Q03164 4/20 0.31
HTT P42858 3/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
RECQL P46063 1/20 0.31
ALDH1A1 P00352 2/20 0.31
PSEN1 P49768 2/20 0.31
PSEN2 P49810 2/20 0.31
APH1B Q8WW43 2/20 0.31
NCSTN Q92542 2/20 0.31
APH1A Q96BI3 2/20 0.31
PSENEN Q9NZ42 2/20 0.31
CCR4 P51679 1/20 0.31

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
SCHEMBL4646800 0.95 P2RY12 (0.55) P2RY12FBP1MAPTSLC22A12F10
SCHEMBL4686051 0.95 P2RY12 (0.57) P2RY12FBP1MAPTSLC22A12F10
SCHEMBL4685308 0.93 P2RY12 (0.55) P2RY12FBP1MAPTSLC22A12F10
SCHEMBL4686749 0.91 P2RY12 (0.60) P2RY12FBP1MAPTSLC22A12F10
SCHEMBL4688906 0.91 P2RY12 (0.59) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL4683560 0.91 P2RY12 (0.53) P2RY12FBP1MAPTPSEN1PSEN2
SCHEMBL4860490 0.90 P2RY12 (0.58) P2RY12FBP1MAPTF10MEN1
SCHEMBL4685193 0.89 P2RY12 (0.52) P2RY12FBP1MAPTF10MEN1
SCHEMBL4689919 0.89 P2RY12 (0.57) P2RY12FBP1MAPTSLC22A12MEN1
SCHEMBL4647663 0.89 P2RY12 (0.55) P2RY12FBP1MAPTSLC22A12CCR4

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
EP-1667989-A4 SUBSTITUTED ISOQUINOLINONES PORTOLA PHARM INC (US) 2008-08-20 EP disclosed
US-7294635-B2 Substituted isoquinolinones PORTOLA PHARMACEUTICALS, INC. (US) 2007-11-13 US disclosed
US-7294635-B2 Substituted isoquinolinones PORTOLA PHARMACEUTICALS, INC. (US) 2007-11-13 US disclosed
US-7294635-B2 Substituted isoquinolinones PORTOLA PHARMACEUTICALS, INC. (US) 2007-11-13 US disclosed
EP-1667989-A1 SUBSTITUTED ISOQUINOLINONES Portola Pharmaceuticals, Inc. (US) 2006-06-14 EP disclosed
US-20050113399-A1 Substituted isoquinolinones PORTOLA PHARMACEUTICALS, INC. (US) 2005-05-26 US disclosed
WO-2005035520-A1 SUBSTITUTED ISOQUINOLINONES PORTOLA PHARMACEUTICALS, INC. (US) 2005-04-21 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-20050113399-A1 Substituted isoquinolinones PFKP, MPL, TBXA2R P2RY12 67/4885FBP1 3650/4885MAPT 4564/4885

“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.