SCHEMBL8226571

SCHEMBL8226571

CCOC(=O)[C@@H]1CCN[C@H]1c1ccccc1S(=O)(=O)C1CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SLC6A2 P23975 3/20 0.37
SLC6A3 Q01959 3/20 0.37
SLC6A4 P31645 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36
CTSS P25774 1/20 0.36
HTR6 P50406 1/20 0.36
CYP2C19 P33261 3/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL8225004 1.00 PKM (0.44) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL8226803 1.00 PKM (0.44) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL8221416 1.00 PKM (0.44) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL8263932 1.00 PKM (0.44) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL13613628 0.88 PKM (0.46) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL11347961 0.85 PKM (0.43) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL13613727 0.85 PKM (0.43) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL11347964 0.85 PKM (0.43) PKMMAPTMEN1KMT2ASLC6A2
SCHEMBL8263934 0.82 SLC1A2 (0.36) MAPTNPSR1HTR6CYP2C19CA12
SCHEMBL8224166 0.81 KMT2A (0.43) PKMMAPTKMT2ACYP2C19CYP3A4

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
EP-2061756-B1 2-AMINOCARBONYLPHENYLAMINO-2-PHENILACETAMIDES AS FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2013-09-25 EP disclosed
US-8222453-B2 Benzamide factor VIIa inhibitors useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2012-07-17 US disclosed
US-20100227894-A1 BENZAMIDE FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY 2010-09-09 US disclosed
EP-1856096-B1 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-09-01 EP disclosed
US-7622585-B2 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-24 US disclosed
WO-2007146719-A2 2-AMINOCARBONYLPHENYLAMINO-2-PHENYLACETAMIDES AS FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-21 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-20100227894-A1 BENZAMIDE FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS F7, F9, F8 PKM 1504/4885MAPT 1524/4885MEN1 1914/4885

“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.