SCHEMBL7123078

SCHEMBL7123078

N=C(N)c1cccc(C2Sc3ccccc3N(CCCCCN3CCCCC3)C2=O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.68
PRSS1 P07477 10/20 0.68
F2 P00734 9/20 0.68
PLG P00747 5/20 0.68
PROC P04070 1/20 0.49
FPR2 P25090 2/20 0.40
HRH3 Q9Y5N1 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
OPRM1 P35372 1/20 0.37
OPRD1 P41143 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
SCHEMBL7115766 0.91 F10 (0.56) F10PRSS1F2PLGPROC
SCHEMBL7126671 0.91 F10 (0.70) F10PRSS1F2PLGPROC
SCHEMBL7116633 0.91 F10 (0.56) F10PRSS1F2PLGPROC
SCHEMBL7126768 0.89 F10 (0.54) F10PRSS1F2PLGPROC
SCHEMBL7119611 0.89 F10 (0.54) F10PRSS1F2PLGPROC
SCHEMBL7121864 0.88 F10 (0.53) F10PRSS1F2PLGPROC
SCHEMBL7123964 0.88 F10 (0.53) F10PRSS1F2PLGPROC
SCHEMBL7112907 0.88 F10 (0.53) F10PRSS1F2PLGPROC
SCHEMBL7112913 0.87 F10 (0.52) F10PRSS1F2PLGPROC
SCHEMBL7114484 0.87 F10 (0.51) F10PRSS1F2PLGPROC

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030187256-A1 Benoxazinones/benzothiazinones as serine protease inhibitors BERRYMAN KENT ALAN (US) 2003-10-02 US claimed
EP-1068191-A1 BENZOXAZINONES/BENZOTHIAZINONES AS SERINE PROTEASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2001-01-17 EP claimed
WO-1999050257-A1 BENZOXAZINONES/BENZOTHIAZINONES AS SERINE PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1999-10-07 WO claimed
US-20030187256-A1 Benoxazinones/benzothiazinones as serine protease inhibitors BERRYMAN KENT ALAN (US) 2003-10-02 US disclosed
US-6509335-B1 This invention discloses benzoxazinone and benzothiazinone compounds which display inhibitory effects on serine proteases such as factor Xa, thrombin, and/or factor VIIa. The invention also discloses pharmaceutically acceptable salts of WARNER-LAMBERT COMPANY 2003-01-21 US disclosed
WO-2001026575-A9 METHODS OF DIAGNOSING AND TREATING URINARY INCONTINENCE UNIV LELAND STANFORD JUNIOR (US) 2002-11-28 WO disclosed
US-6420119-B1 DIAGNOSING UROGENITAL DISORDERS; OBTAIN TISSUE, MONITOR PROTEOLYSIS OF SUPPORT TISSUES, CLASSIFY UROGENITAL DISORDERS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIVERSITY 2002-07-16 US disclosed
WO-2001026575-A1 METHODS OF DIAGNOSING AND TREATING URINARY INCONTINENCE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIVERSITY (US) 2001-04-19 WO disclosed
EP-1068191-A1 BENZOXAZINONES/BENZOTHIAZINONES AS SERINE PROTEASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2001-01-17 EP disclosed
WO-1999050257-A1 BENZOXAZINONES/BENZOTHIAZINONES AS SERINE PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1999-10-07 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-20030187256-A1 Benoxazinones/benzothiazinones as serine protease inhibitors HABP2, SPINT2, SERPINB1 F10 24/4885PRSS1 8/4885F2 25/4885

“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.